1-BROMOHEXANE

1-Bromohexane is organobromine compound with formula Br(CH2)5CH3.
1-Bromohexane is a colorless liquid.
1-Bromohexane is utilized in the preparation of pharmaceuticals and organic chemicals.

CAS Number: 111-25-1
EC Number: 203-850-2
Molecular Formula: C6H13Br
Molar Mass: 165.07

1-Bromohexane is involved in Grignard reactions as an alkylating agent and in the synthesis of bromo-cyclic compounds.
1-Bromohexane can form Grignard reagents.

Applications of 1-Bromohexane:
1-Bromohexane is a very useful synthetic intermediate for pharmaceuticals and organic chemicals.
1-Bromohexane can be used to react with Mg to prepare Grignard reagents which play an important role in formation of carbon-carbon bond.

Synthesis and reactions of 1-Bromohexane:
Most 1-bromoalkanes are prepared by free-radical addition of hydrogen bromide to the 1-alkene.
These conditions lead to anti-Markovnikov addition, giving the 1-bromo derivative.

1-Bromohexane undergoes reactions expected of simple alkyl bromides.
1-Bromohexane reacts with potassium fluoride to give the corresponding fluorocarbons.

Uses of 1-Bromohexane:
1-Bromohexane is used as solvent in organic synthesis.
1-Bromohexane is used as a solvent and also used in organic synthesis

production method of 1-Bromohexane:
16g(0.1mol) of bromine is dissolved in 50mL of carbon tetrachloride, and slowly and gradually added to 13g(0.1mol) heptanoic acid and 22g(0.0945m mercury chloride and 150mL of dry carbon tetrachloride solution under stirring.
The reflux filtrate of the mixture is washed with 5% NaOH solution, then washed with water, and anhydrous sulfur night.
Fractionated 6g(36%)1-bromohexane.

Description of 1-Bromohexane:
1-Bromohexane is a liquid organohalide with structural formula Br-CH2-CH2-CH2-CH2-CH2-CH3.

Applications of 1-Bromohexane:
B 2152 (OTTO) 1-Bromohexane, 98% - used to manufacture pharmaceuticals and organic chemicals.
1-Bromohexane is also a solvent that is frequently used in grignard reactions, that are involved with creating bromo-cyclic compounds.

Chemical nature of 1-Bromohexane:
1-Bromohexane is organobromine compound with formula Br(CH2)5CH3.
1-Bromohexane is a colorless liquid.

1-Bromohexane undergoes reactions expected of simple alkyl bromides.
1-Bromohexane can form Grignard reagents.
1-Bromohexane reacts with potassium fluoride to give the corresponding fluorocarbons.

Chemical Properties of 1-Bromohexane:
1-Bromohexane is a colourless liquid organohalide.
1-Bromohexane is a solvent that is frequently used in grignard reactions.
1-Bromohexane is also used as Intermediate, for introduction of hexyl group.

Description of 1-Bromohexane:
1-Bromohexane-6,6,6-D3 is a chemical compound that belongs to the class of alkyl halides.
1-Bromohexane is commonly used in various fields such as medical research, environmental research, and industrial research.
This paper aims to provide a comprehensive review of 1-Bromohexane-6,6,6-D3, including its synthesis methods, chemical structure, biological activity, effects on cell function and signal transduction, applications in different research fields, and future perspectives and challenges.

Method of Synthesis or Extraction of 1-Bromohexane:
1-Bromohexane-6,6,6-D3 can be synthesized using several methods, including the reaction of 1-hexanol with hydrobromic acid.
This method involves the addition of hydrobromic acid to 1-hexanol, followed by refluxing the mixture under specific conditions.

Another commonly used method is the reaction of 1-hexene with hydrogen bromide.
This method yields 1-Bromohexane-6,6,6-D3 with high efficiency and good yield.

When considering the efficiency and yield of each method, the reaction of 1-hexene with hydrogen bromide is generally more efficient and provides higher yields compared to the reaction of 1-hexanol with hydrobromic acid.
However, both methods can be optimized to improve efficiency and yield.

1-Bromohexane is utilized in the preparation of pharmaceuticals and organic chemicals.

KEYWORDS:
1-BROMOHEXANE, 111-25-1, Hexyl bromide, n-Hexyl bromide, Bromohexane, 1-Hexyl bromide, Hexane 1-bromo-, Pentane bromomethyl-, 1-bromo-hexane, 1-BroMohexane--d2

Environmental and safety considerations are crucial in the synthesis of 1-Bromohexane-6,6,6-D3.
Both methods involve the use of hazardous chemicals, such as hydrobromic acid and hydrogen bromide, which can be harmful to the environment and human health if not handled properly.
Proper safety measures, such as the use of protective equipment and proper waste disposal, should be followed to minimize environmental impact and ensure the safety of researchers and workers involved in the synthesis process.

Chemical Structure and Biological Activity of 1-Bromohexane:
The chemical structure of 1-Bromohexane-6,6,6-D3 consists of a hexane backbone with a bromine atom attached to one of the carbon atoms.
The deuterium atoms (D3) indicate the presence of three deuterium isotopes, which can have significant implications for its biological activity.

The mechanism of action and biological targets of 1-Bromohexane-6,6,6-D3 are not well-studied.
However, 1-Bromohexane is known to exhibit bioactivity and potency in certain biological systems.
Further research is needed to elucidate its precise mechanism of action and identify its specific biological targets.

Biological Effects of 1-Bromohexane:
1-Bromohexane-6,6,6-D3 has been shown to have effects on cell function and signal transduction.
1-Bromohexane can potentially interfere with cellular processes and disrupt normal signaling pathways.

These effects can have both therapeutic and toxic implications, depending on the context and concentration of the compound.
In terms of potential therapeutic effects, 1-Bromohexane-6,6,6-D3 has shown promise in drug development research.

1-Bromohexane may have applications in the treatment of certain diseases or conditions, although further studies are needed to validate its efficacy and safety.
On the other hand, the toxic effects of 1-Bromohexane-6,6,6-D3 should not be overlooked.

High concentrations or prolonged exposure to the compound can lead to adverse effects on cell viability and function.
Careful consideration of dosage and exposure limits is necessary to avoid potential toxicity.

Applications of 1-Bromohexane:
1-Bromohexane-6,6,6-D3 has various applications in different research fields.
In medical research, 1-Bromohexane plays a role in drug development by serving as a starting material or intermediate in the synthesis of pharmaceutical compounds.

Clinical trials and findings related to the compound's therapeutic potential are still limited, but ongoing research may uncover its benefits and potential side effects.
In environmental research, 1-Bromohexane-6,6,6-D3 is used to study its effects on ecosystems and its role in pollution management.

1-Bromohexanes impact on the environment and sustainability should be carefully evaluated to minimize any adverse effects.
In industrial research, 1-Bromohexane-6,6,6-D3 finds applications in manufacturing processes, particularly in improving product quality and efficiency.
Health and safety considerations are of utmost importance in industrial settings to protect workers and prevent any potential hazards associated with the compound.

Future Perspectives and Challenges of 1-Bromohexane:
Despite the potential applications of 1-Bromohexane-6,6,6-D3, there are current limitations in its use and study.
The lack of comprehensive research on its mechanism of action, biological targets, and long-term effects hinders its widespread adoption in various fields.

Further studies are needed to address these limitations and provide a more thorough understanding of the compound.
Possible solutions and improvements include conducting more in-depth research on the compound's biological activity, exploring its potential therapeutic applications, and optimizing synthesis methods to improve efficiency and yield.

Collaboration between different research fields and the development of advanced analytical techniques can also contribute to overcoming current challenges.
Future trends and prospects in the application of 1-Bromohexane-6,6,6-D3 in scientific research include the discovery of new biological targets, the development of more efficient synthesis methods, and the identification of potential therapeutic uses. Continued research and advancements in the field may lead to the development of novel drugs or applications in various industries.

In conclusion, 1-Bromohexane-6,6,6-D3 is a compound with diverse applications in medical research, environmental research, and industrial research.
1-Bromohexanes synthesis methods, chemical structure, biological activity, and potential applications have been discussed in this paper.
However, further research is needed to fully understand its mechanism of action, biological targets, and long-term effects, as well as to explore its potential therapeutic and industrial applications.

Uses of 1-Bromohexane:
1-Bromohexane is utilized in the preparation of pharmaceuticals and organic chemicals.
1-Bromohexane is involved in Grignard reactions as an alkylating agent and in the synthesis of bromo-cyclic compounds.

Applications of 1-Bromohexane:
1-Bromohexane is a very useful synthetic intermediate，it can be used to react with Mg to prepare Grignard reagents which play an important role in formation of carbon-carbon bond.

Introduction to 1-Bromohexane:
1-Bromohexane, also known as n-hexyl bromide, is a colorless liquid that is used in various scientific experiments, research studies, and industrial applications.
In this paper, we will explore several aspects of 1-bromohexane, including its definition and background, physical and chemical properties, synthesis and characterization, analytical methods, biological properties, toxicity and safety in scientific experiments, applications in scientific experiments, current state of research, potential implications in various fields of research and industry, limitations, and future directions.

Definition and Background of 1-Bromohexane:
1-Bromohexane is a halogenated hydrocarbon that belongs to the alkyl halide family.
1-Bromohexane is a six-carbon chain that contains a bromine atom attached to the first carbon, denoted as "1-bromo" hexane.

1-Bromohexane has a molecular weight of 165.04 g/mol, a boiling point of 156-157°C, and a melting point of -86°C.
1-Bromohexane is commonly used in organic synthesis, as it is an excellent source of the 1-Bromohexane group.

Physical and Chemical Properties of 1-Bromohexane:
1-Bromohexane is a colorless liquid with a sweet odor and a density of 1.18 g/cm³ at 20°C.
1-Bromohexane is insoluble in water, but soluble in organic solvents such as ethanol, ether, and chloroform.

1-Bromohexane has a refractive index of 1.429, a flashpoint of 45°C, and a viscosity of 2.22 mPa·s at 20°C.
1-Bromohexane is highly flammable and toxic when ingested or inhaled.

Synthesis and Characterization of 1-Bromohexane:
1-Bromohexane can be synthesized by the reaction of n-hexanol with hydrobromic acid in the presence of sulfuric acid.

The reaction is represented as follows:
C6H13OH + HBr → C6H13Br + H2O

The synthesized compound can be characterized using various techniques such as nuclear magnetic resonance (NMR) spectroscopy, infrared (IR) spectroscopy, and gas chromatography-mass spectrometry (GC-MS).
NMR spectroscopy determines the chemical structure of the compound by measuring the interactions between atomic nuclei and magnetic fields.

IR spectroscopy identifies the functional groups present in the compound through the absorption of infrared radiation.
GC-MS separates the individual components of a mixture and identifies them based on their mass-to-charge ratio.

Analytical Methods of 1-Bromohexane:
1-Bromohexane can be analyzed using various analytical methods such as gas chromatography (GC), high-performance liquid chromatography (HPLC), and spectrophotometry.
GC separates the individual components of a mixture based on their volatility and affinity for a stationary phase.

HPLC separates the individual components of a mixture based on their polarity and affinity for a stationary phase.
Spectrophotometry measures the absorption or transmission of light by a sample at a specific wavelength.

Biological Properties of 1-Bromohexane:
1-Bromohexane has both antifungal and antibacterial properties.
1-Bromohexane has been shown to inhibit the growth of various fungal and bacterial strains, including Candida albicans and Escherichia coli.
However, 1-Bromohexane is also toxic to humans and animals, and exposure to the compound can cause various health problems.

Toxicity and Safety in Scientific Experiments of 1-Bromohexane:
1-Bromohexane is toxic when ingested, inhaled, or absorbed through the skin.
1-Bromohexane can cause dizziness, nausea, vomiting, headaches, respiratory problems, and skin irritation.
Therefore, 1-Bromohexane should be handled with extreme caution in scientific experiments, and proper safety measures should be followed to minimize exposure.

Applications in Scientific Experiments of 1-Bromohexane:
1-Bromohexane is commonly used in organic synthesis, especially in the production of 1-Bromohexane derivatives.
1-Bromohexane is also used as a solvent, surfactant, and reagent in various reactions, such as nucleophilic substitution and Grignard reactions.
1-Bromohexane has been used in the synthesis of various compounds such as surfactants, lubricants, and bioactive molecules.

Current State of Research about 1-Bromohexane:
Current research on 1-Bromohexane is focused on its applications in organic synthesis, its biological properties, and its potential implications in various fields of research and industry.
Several studies have been conducted to evaluate the toxicity and safety of 1-Bromohexane in humans and animals.
Other studies have explored its potential as an antibacterial and antifungal agent and its applications in drug discovery and development.

Potential Implications in Various Fields of Research and Industry:
1-Bromohexane has potential implications in various fields of research and industry, including organic synthesis, drug discovery, and material science.
1-Bromohexanes use as a surfactant and reagent in organic synthesis makes it a valuable compound for the manufacture of various products.

1-Bromohexanes antibacterial and antifungal properties make it a potential candidate for the development of new drugs.
1-Bromohexane can also be used in the production of lubricants and polymers.

Limitations and Future Directions of 1-Bromohexane:
Despite its potential applications, 1-Bromohexane has several limitations, including its toxicity and safety concerns.
Future research should focus on developing safer and less toxic alternatives to this compound. Other areas of research include exploring the potential of 1-Bromohexane in drug discovery and development and its applications in material science.

Conclusion:
In conclusion, 1-Bromohexane is a valuable compound in organic synthesis, research studies, and industrial applications.
1-Bromohexanes physical and chemical properties, synthesis and characterization, analytical methods, biological properties, and potential implications in various fields of research and industry have been discussed in this paper.

The toxicity and safety concerns associated with this compound highlight the importance of proper safety measures in scientific experiments.
Further research is needed to explore the full potential of 1-Bromohexane in various applications and to develop safer alternatives.

Preferred IUPAC name:
1-Bromohexane

Other names:
Bromohexane
Hexyl bromide}
1-Hexyl bromide
n-Hexyl bromide

Identifiers of 1-Bromohexane:
CAS Number: 111-25-1
Beilstein Reference:1731290
ChemSpider: 7810
ECHA InfoCard:100.003.501
EC Number: 203-850-2
MeSH: 1-bromohexane
PubChem CID:8101
RTECS number: MO0925000
UNII:WVA0FAX7GA
UN number: 1993
CompTox Dashboard (EPA):DTXSID4021929

Physico-chemical Properties of 1-Bromohexane:
Molecular Formula: C6H13Br
Molar Mass: 165.07
Density: 1.176g/mLat 25°C(lit.)
Melting Point: −85°C(lit.)
Boling Point: 154-158°C(lit.)
Flash Point: 135°F
Water Solubility: Immiscible with water.
Vapor Presure: <10 mm Hg ( 20 °C)
Vapor Density: 5.7 (vs air)
Appearance: Liquid
Color: Clear
BRN: 1731290
Storage Condition: Store below +30°C.
Stability: Stable. Incompatible with strong oxidizing agents, strong bases. Combustible.
Refractive Index: n20/D 1.448(lit.)
Physical and Chemical Properties: Density 1.176
melting point: -85°C
boiling point: 154-158°C
refractive index: 1.4465-1.4485
flash point: 57°C
Use: Used as a solvent, but also for organic synthesis

Properties of 1-Bromohexane:
Chemical formula: C6H13Br
Molar mass: 165.074 g·mol−1
Appearance: Colorless liquid
Density: 1.176 g/mL
Melting point: −84.70 °C; −120.46 °F; 188.45 K
Boiling point: 154 to 158 °C; 309 to 316 °F; 427 to 431 K
Solubility in water: Insoluble
Solubility: Alcohol, ether
Refractive index (nD): 1.448 (20 °C, D)

Thermochemistry of 1-Bromohexane:
Heat capacity (C): 219.7 J K−1 mol−1
Std molar entropy (S⦵298): 452.92 J K−1 mol−1
Std enthalpy of formation (ΔfH⦵298): −196.1–−192.9 kJ mol−1
Std enthalpy of combustion (ΔcH⦵298): −4026.2–−4023.0 kJ mol−1

Description of 1-Bromohexane:
Catalogue Number: 801603
Synonyms: Hexyl bromide
Description: 1-Bromohexane

Product Information of 1-Bromohexane:
CAS number: 111-25-1
EC number: 203-850-2
Hill Formula: C₆H₁₃Br
Chemical formula: CH₃(CH₂)₅Br
Molar Mass: 165.08 g/mol
HS Code: 2903 69 19

Molecular Weight: 165.07 g/mol
XLogP3: 3.8
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 0
Rotatable Bond Count: 4
Exact Mass: 164.02006 g/mol
Monoisotopic Mass: 164.02006 g/mol
Topological Polar Surface Area: 0Å²
Heavy Atom Count: 7
Formal Charge: 0
Complexity: 27.4
Isotope Atom Count: 0
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Covalently-Bonded Unit Count: 1
Compound Is Canonicalized: Yes

SYNONYMS:
1-BROMOHEXANE
111-25-1
Hexyl bromide
n-Hexyl bromide
Bromohexane
1-Hexyl bromide
Hexane, 1-bromo-
Pentane, bromomethyl-
1-bromo-hexane
1-BroMohexane--d2
1-BroMohexane--d4
UNII-WVA0FAX7GA
WVA0FAX7GA
EINECS 203-850-2
NSC 71206
AI3-28588
DTXSID4021929
MFCD00000271
NSC-71206
EC 203-850-2
1-BROMOHEXANE-2,2,3,3,4,4,5,5,6,6,6-D11
Hexane, bromo-
2159-17-3
350818-70-1
78904-38-8
hexylbromide
n-hexylbromide
1-hexylbromide
6-bromohexane
1-bromohexan
1-bromanylhexane
1 -bromohexane
Bromo-1 hexane
1-bromo-n-hexane
Hexane, 1-bromo
25495-91-4
1-Bromohexane, 98%
1-bromo-5-methylpentane
NCIOpen2_000490
SCHEMBL33363
DTXCID101929
CHEMBL3187491
Bromohexane; (n-Hexyl bromide)
NSC71206
Tox21_202719
BBL012217
STL163558
AKOS000118767
NCGC00260267-01
BP-31175
CAS-111-25-1
LS-75012
VS-03238
1-Bromohexane, purum, >=98.0% (GC)
B0600
FT-0607533
EN300-19402
A802329
J-504466
Q3292844
F0001-0236
InChI=1/C6H13Br/c1-2-3-4-5-6-7/h2-6H2,1H
111-25-1 [RN]
1-Bromhexan [German] [ACD/IUPAC Name]
1-Bromohexane [ACD/IUPAC Name]
1-Bromohexane [French] [ACD/IUPAC Name]
203-850-2 [EINECS]
Hexane, 1-bromo- [ACD/Index Name]
Hexyl bromide
MO0925000
[111-25-1] [RN]
1219802-83-1 [RN]
130131-94-1 [RN]
192863-46-0 [RN]
1-bromanylhexane
1-Bromo-1,1-dideuteriohexane
1-Bromo-hexane
1-Bromohexane-1,1,2,2-d4
1-Bromohexane-1,1-d2
1-Bromohexane-2,2,3,3,4,4,5,5,6,6,6-d11
1-Bromohexane-4,4,5,5,6,6,6-d7
1-Bromohexane-6,6,6-d3
1-Bromohexane-d13
1-BroMohexane--d4
1-bromo-hexano [Portuguese]
1-Hexyl bromide
2159-17-3 [RN]
25495-91-4 [RN]
350818-70-1 [RN]
78904-38-8 [RN]
bromohexane [Wiki]
EINECS 203-850-2
Hexane, 1-bromo
hexane, bromo-
HexylBromide
Labotest-bb ltbb001158
MO 0925000
n-Hexyl Bromide
n-hexylbromide
Pentane, bromomethyl-
VS-03238