2-BUTYLAMINOETHANOL

CAS Number: 111-75-1
EC Number: 203-904-5
Linear Formula: CH3(CH2)3NHCH2CH2OH
Molecular Weight: 117.19

2-Butylaminoethanol is a compound that contains hydrochloric acid, amines, and a hydroxyl group.
2-Butylaminoethanol is used as an antimicrobial agent and has been shown to have inhibitory effects against many bacteria.

2-Butylaminoethanol's antimicrobial activity is due to its ability to cause aggregation of the bacterial cell membrane by reacting with the fatty acids in the cell membrane.
The reaction mechanism involves an initial reaction between the carbonyl group and the polycarboxylic acid groups on the cell surface, which leads to a decrease in cell surface charge.

This leads to an increase in the permeability of the cells, which causes water loss and eventually death.
Activation energies for this reaction are found by titration calorimetry experiments and are 59 kJ/mol for 2-butoxyethylene glycol ethers and 64 kJ/mol for 2-butyliminoethanol.

General description of 2-Butylaminoethanol:
2-Butylaminoethanol is a secondary amine having a -OH group.

Applications of 2-Butylaminoethanol:
2-Butylaminoethanol (N-Butylethanolamine) may be employed for the synthesis of 4-alkylamino-2,5,6-trimethyl -7-(2,4,6-trimethylphenyl)pyrrolo[2,3-d]pyrimidines and N-butyl-N-(2-nitroxyethyl)nitramine (BuNENA).

Product description of 2-Butylaminoethanol:
2-Butylaminoethanol (BAE) is available as a colorless to light yellow liquid with a slight odor.
2-Butylaminoethanol, an excellent multipurpose alkanolamine, can provide for enhanced corrosion inhibition and stability in formulated emulsion products.

Chemical Properties of 2-Butylaminoethanol:
2-Butylaminoethanol is a colorless liquid.

General Description of 2-Butylaminoethanol:
2-Butylaminoethanol is a secondary amine having a -OH group.

Safety Profile of 2-Butylaminoethanol:
2-Butylaminoethanol is moderately toxic by ingestion and intraperitoneal routes.
2-Butylaminoethanol is skin and severe eye irritant.
2-Butylaminoethanol is combustible when exposed to heat or flame.
To fight fire, use alcohol foam, foam, Con, dry chemical.
2-Butylaminoethanol is incompatible with oxihzing materials.
When heated to decomposition 2-Butylaminoethanol emits toxic fumes of NOx

About 2-Butylaminoethanol Helpful information:
2-Butylaminoethanol is registered under the REACH Regulation and is manufactured in and / or imported to the European Economic Area, at ≥ 100 to < 1 000 tonnes per annum.
2-Butylaminoethanol is used in articles, by professional workers (widespread uses), in formulation or re-packing, at industrial sites and in manufacturing.

Consumer Uses of 2-Butylaminoethanol:
ECHA has no public registered data indicating whether or in which chemical products 2-Butylaminoethanol might be used.
ECHA has no public registered data on the routes by which 2-Butylaminoethanol is most likely to be released to the environment.

Article service life of 2-Butylaminoethanol:
Other release to the environment of 2-Butylaminoethanol is likely to occur from: outdoor use in long-life materials with low release rate (e.g. metal, wooden and plastic construction and building materials) and indoor use in long-life materials with low release rate (e.g. flooring, furniture, toys, construction materials, curtains, foot-wear, leather products, paper and cardboard products, electronic equipment).
2-Butylaminoethanol can be found in products with material based on: plastic (e.g. food packaging and storage, toys, mobile phones).

Widespread uses by professional workers of 2-Butylaminoethanol:
2-Butylaminoethanol is used in the following products: coating products and laboratory chemicals.
2-Butylaminoethanol is used in the following areas: scientific research and development.
Other release to the environment of 2-Butylaminoethanol is likely to occur from: indoor use (e.g. machine wash liquids/detergents, automotive care products, paints and coating or adhesives, fragrances and air fresheners), outdoor use, indoor use in close systems with minimal release (e.g. cooling liquids in refrigerators, oil-based electric heaters) and outdoor use in close systems with minimal release (e.g. hydraulic liquids in automotive suspension, lubricants in motor oil and break fluids).

Formulation or re-packing of 2-Butylaminoethanol:
2-Butylaminoethanol is used in the following products: coating products and laboratory chemicals.
Release to the environment of 2-Butylaminoethanol can occur from industrial use: formulation of mixtures.

Uses at industrial sites of 2-Butylaminoethanol:
2-Butylaminoethanol is used in the following products: coating products and laboratory chemicals.
2-Butylaminoethanol is used in the following areas: scientific research and development.
Release to the environment of 2-Butylaminoethanol can occur from industrial use: in processing aids at industrial sites, in the production of articles, of substances in closed systems with minimal release, as an intermediate step in further manufacturing of another substance (use of intermediates) and as processing aid.

Manufacture of 2-Butylaminoethanol:
Release to the environment of 2-Butylaminoethanol can occur from industrial use: manufacturing of the substance.

Description of 2-Butylaminoethanol:
Catalogue Number: 818661
Synonyms: N-tert-Butylethanolamin

Applications of 2-Butylaminoethanol:
2-Butylaminoethanol is an intermediate used to prepare 2-arylimino-1,3-thiazolidines as progesterone receptor binding ligands.

Product Information of 2-Butylaminoethanol:
CAS number: 4620-70-6
EC number: 225-034-5
Hill Formula: C₆H₁₅NO
Chemical formula: (CH₃)₃CNHCH₂CH₂OH
Molar Mass: 117.19 g/mol
HS Code: 2922 19 00

2-Butylaminoethanol is a compound that contains hydrochloric acid, amines, and a hydroxyl group.

KEYWORDS:
111-75-1, 203-904-5, 2-(N-Monobutylamino)ethanol, 2-n-Butylaminoethanol, Butyl(2-hydroxyethyl)amine, Butylethanolamine, UNII-3IBO99KPV6, NSC 1098, 3IBO99KPV6, BRN 1732522

Applications of 2-Butylaminoethanol:
Application 2-tert-Butylamino-ethanol for synthesis.
CAS No. 4620-70-6, EC Number 225-034-5.

Physicochemical Information of 2-Butylaminoethanol:
Boiling point: 176 - 177 °C (1013 hPa)
Density: 0.867 g/cm3
Flash point: 69 °C
Melting Point: 42 - 46 °C

PROPERTIES of 2-Butylaminoethanol:
Quality Level:
100

assay:
≥98%

refractive index:
n20/D 1.444 (lit.)

bp:
198-200 °C (lit.)

density:
0.891 g/mL at 25 °C (lit.)

SMILES string:
CCCCNCCO

InChI:
1S/C6H15NO/c1-2-3-4-7-5-6-8/h7-8H,2-6H2,1H3

InChI key:
LJDSTRZHPWMDPG-UHFFFAOYSA-N

Synonym(s):
N-Butyl-2-hydroxyethylamine, N-Butylethanolamine

Beilstein:
1732522

MDL number:
MFCD00020570

PubChem Substance ID:
24870738

NACRES:
NA.22

Application: CAS: 111-75-1, MF: C6H15NO, MW: 117.19
CAS Number: 111-75-1
Molecular Weight: 117.19
Molecular Formula: C6H15NO

Chemical Name: 2-(BUTYLAMINO)ETHANOL
Synonyms: BMEA;Ethanol, 2-(butylamino)-;ceshi;ceshis;Butylethanolamine;butylethanalamine;Buthylethanolamine;2-butylamino-ethano;n-Butylaminoethanol;N-BUTYLETHANOLAMINE
CBNumber: CB3397675
Molecular Formula: C6H15NO
Molecular Weight: 117.19
MDL Number: MFCD00020570
MOL File: 111-75-1.mol

Names and Identifiers of 2-Butylaminoethanol:
Name: 2-butylaminoethanol
Synonyms: Ethanol-n-butylamine
CAS: 111-75-1
EINECS: 203-904-5
InChI: InChI=1/C6H15NO/c1-2-3-4-7-5-6-8/h7-8H,2-6H2,1H3

Physico-chemical Properties of 2-Butylaminoethanol:
Molecular Formula: C6H15NO
Molar Mass: 117.189
Density: 0.875g/cm3
Boling Point: 199.1°C at 760 mmHg
Flash Point: 79.3°C
Vapor Presure: 0.0875mmHg at 25°C
Refractive Index: 1.435

Specifications of 2-Butylaminoethanol:

CAS:
111-75-1

Boiling Point:
199°C

MDL Number:
MFCD00020570

Quantity:
25mL

InChI Key:
LJDSTRZHPWMDPG-UHFFFAOYSA-N

IUPAC Name:
2-(butylamino)ethan-1-ol

PubChem CID:
8132

Physical Form:
Clear Liquid at 20°C

Chemical Name or Material:
2-(Butylamino)ethanol

Color:
Colorless

Molecular Formula:
C6H15NO

UN Number:
2735

Synonym:
N-Butylethanolamine

SMILES:
CCCCNCCO

Molecular Weight (g/mol):
117.19

Formula Weight:
117.19

Percent Purity:
≥98.0% (GC,T)

2-(BUTYLAMINO)ETHANOL Properties:
Melting point: 28.94°C (estimate)
Boiling point: 198-200 °C(lit.)
Density: 0.891 g/mL at 25 °C(lit.)
refractive index: n20/D 1.444(lit.)
Flash point: 170 °F
storage temp.: 2-8°C
solubility: 1000g/l
pka: 14.81±0.10(Predicted)
Specific Gravity: 0.893
PH: 11.9 (100g/l, H2O, 20℃)
explosive limit: 1.5-8.6%(V)
BRN: 1732522
InChIKey: LJDSTRZHPWMDPG-UHFFFAOYSA-N
CAS DataBase Reference: 111-75-1(CAS DataBase Reference)
EWG's Food Scores: 1-3
FDA UNII: 3IBO99KPV6
EPA Substance Registry System: Ethanol, 2-(butylamino)- (111-75-1)

Molecular Weight: 117.19
XLogP3-AA: 0.4
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 2
Rotatable Bond Count: 5
Exact Mass: 117.115364102
Monoisotopic Mass: 117.115364102
Topological Polar Surface Area: 32.3 Å²
Heavy Atom Count: 8
Formal Charge: 0
Complexity: 39.5
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:
2-(N-Monobutylamino)ethanol; 2-Butylaminoethanol; 2-n-Butylaminoethanol; Butyl(2-hydroxyethyl)amine; Butylethanolamine; Butylmonoethanolamine; N-Butyl monoethanolamine; n-Butylaminoethanol; n-Butylethanolamine; N-Butylethanolamine; Ethanol, 2-(butylamino)-; [ChemIDplus] N-Butyl-2-hydroxyethylamine; [Sigma-Aldrich MSDS] UN2735

2-(Butylamino)ethanol
111-75-1
2-Butylaminoethanol
N-Butylethanolamine
Ethanol, 2-(butylamino)-
n-Butylaminoethanol
Butylmonoethanolamine
N-Butyl monoethanolamine
2-(N-Butylamino)ethanol
Butyl(2-hydroxyethyl)amine
2-(N-Monobutylamino)ethanol
N-n-Butylethanolamine
UNII-3IBO99KPV6
NSC 1098
2-butylamino-ethanol
3IBO99KPV6
Butylethanalamine
2-n-Butylaminoethanol
EINECS 203-904-5
N-Butyl-2-hydroxyethylamine
BRN 1732522
ethanol-n-butylamine
Hydroxyethylbutylamine
2-(butylamino)-ethanol
2-(n-butylamino)-ethanol
EC 203-904-5
SCHEMBL42800
3-04-00-00682 (Beilstein Handbook Reference)
WLN: Q2M4
N-butyl,N-2-hydroxyethylamine
DTXSID9059410
LJDSTRZHPWMDPG-UHFFFAOYSA-
BCP5555
NSC1098
2-(Butylamino)ethanol, >=98%
NSC-1098
ZINC1587838
MFCD00020570
AKOS000120959
MCULE-3582031814
AS-81097
CS-0077079
N-Butylethanolamine;Ethanol, 2-(butylamino)-
W-109415
Q27257261

Regulatory process names:
2-butylaminoethanol
2-butylaminoethanol

CAS names:
Ethanol, 2-(butylamino)-

IUPAC names:
2-(butylamino)ethan-1-ol
2-(Butylamino)ethanol
2-(butylamino)ethanol
2-Butylaminoethanol
2-butylaminoethanol
2-Butylaminoethanol

Trade names:
2-Butylaminoethanol (BAE)
n-Butylaminoethanol

Other identifiers:
111-75-1

111-75-1 [RN]
2-(butylamino)ethan-1-ol
2-(Butylamino)ethanol [ACD/IUPAC Name]
2-(Butylamino)ethanol [German] [ACD/IUPAC Name]
2-(Butylamino)éthanol [French] [ACD/IUPAC Name]
2-(N-butylamino)ethanol
203-904-5 [EINECS]
2-Butylaminoethanol
Butylethanolamine
Ethanol, 2- (butylamino)-
Ethanol, 2-(butylamino)- [ACD/Index Name]
ETHANOL, 2-BUTYLAMINO-
KK0175000
N-Butyl-2-hydroxyethylamine
N-BUTYLETHANOLAMINE
[111-75-1] [RN]
2-(N-Monobutylamino)ethanol
2-Butylamino-ethanol
2-Hydroxyethyl(butyl)amine
2-n-Butylaminoethanol
3-04-00-00682 (Beilstein Handbook Reference) [Beilstein]
4-01-00-02380 [Beilstein]
4-01-00-02392 [Beilstein]
BUCS
Butyl(2-hydroxyethyl)amine
Butylmonoethanolamine
Chimec NR
DEGME
Dowanol 16
Dowanol DM
Dowanol EB [Trade name]
EGBE
EGMBE
EGME, di-
EINECS 203-904-5
Ektasolve DM
Ektasolve EB [Trade name]
Ethanol,2-(butylamino)-
Hydroxyethylbutylamine
Jeffersol DM
Jeffersol EB [Trade name]
M2M
MECB
N-Butyl monoethanolamine
n-Butylaminoethanol
ST5409668
Synergex
WLN: Q2M4