2-Amino-1-butanol

HCID 22129CAS 13054-87-0
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC(N)CO
InChIKey
JCBPETKZIGVZRE-UHFFFAOYSA-N
Molecular formula
C4H11NO
Average molar mass
89.14 g/mol
Monoisotopic mass
89.08406397

Overview

structure

Names & identifiers

Preferred name
2-Amino-1-butanol
IUPAC
2-aminobutan-1-ol
English name
DL-2-Amino-1-butanol
Molecular formula
C4H11NO
Molecular weight
89.14

Names & synonyms

2-Aminobutan-1-ol2-Amino-1-butanol96-20-82-Aminobutanol1-BUTANOL, 2-AMINO-2-Aminobutyl alcoholButanol-2-amine1-(Hydroxymethyl)propylamine2-Amino-1-hydroxybutaneN008Q02GPSNSC-1068DTXSID60859935
Show more names
2-azanylbutan-1-ol1-hydroxy-2-butanamineLABOTEST-BB LT01409643(+/-)-2-AMINO-1-BUTANOL1-Hydroxy-2-aminobutane1-hydroxy-sec-butylamine(±)-2-Amino-1-butanol,97%rac-(S*)-2-Amino-1-butanol
RefChem:85045DTXCID50209465202-488-2235-940-2DL-2-Amino-1-butanol13054-87-01-Hydroxy-2-butylamineaminobutanol

Database identifiers

CAS
13054-87-0、96-20-8
PubChem CID
22129
DTXSID
DTXSID60859935
ChEMBL
CHEMBL327032
UNII
N008Q02GPS
EC Number
202-488-2、235-940-2
Nikkaji
J35.181D

Properties

Computed structural properties

XLogP
-0.4
Topological polar surface area
46.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
6

Experimental & physicochemical properties

Chemical ClassesNitrogen Compounds -> Amino Alcohols, Other
CosmeticsBuffering
SpringerMaterials PropertiesOptical coefficient
Vapor Pressure0.15 [mmHg]
Physical Description · 2 items

Liquid

Liquid; [Merck Index] Colorless hygroscopic liquid with an amine-like odor; [Alfa Aesar MSDS]

Physicochemical properties

Melting point
-2 °C · -2 °C(lit.)
Boiling point
179 · 179-183 °C(lit.)
Density
0.944 g/mL · 0.944 g/mL at 20 °C(lit.)
refractive index
20 · n20/D 1.452
Flash point
184 °F · 184 °F
InChI
InChI=1S/C4H11NO/c1-2-4(5)3-6/h4,6H,2-3,5H2,1H3

Safety & regulation

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 1.8% (5 of 277) of reports.

Danger

H302 (98.2%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 277 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

Hazard information

Regulatory Information · 4 items

Chemical: 1-Butanol, 2-amino-

1-Butanol, 2-amino- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Butanol, 2-amino- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 24-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/12299

2-Amino-1-butanol: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 1-Butanol, 2-amino-: Human health tier II assessment
Hazards SummaryCauses burns; Harmful by ingestion; [ECHA REACH Registrations] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Harmful by ingestion; [Alfa Aesar MSDS]
Hazard Classes and Categories · 3 items

Skin Corr. 1C (100%)

Acute Tox. 4 (98.2%)

Acute toxicity - category 4

Safety & protection

Exposure Control and Personal Protection1.0 [ppm]

Toxicology

Adverse EffectsDermatotoxin - Skin burns.

Safety data

wgk
2
rtecs
EK9625000
ridadr
UN 2735 8/PG 3
risk_code
34
Signal word
Danger
Symbol(GHS)
GHS05

Chemistry & industry

Uses & manufacturing

Uses · 2 items

Used to make surface-active agents, vulcanization accelerators, and pharmaceuticals, and as an emulsifying agent for cosmetic creams and lotions, mineral oil and paraffin wax emulsions, leather dressings, textile specialties, polishes, cleaning compounds, and so-called soluble oils; [Merck Index] Used in metal working fluids, rolling oils, and cleaning agents; [ECHA REACH Registrations]

Metal Machining [Category: Heat or Machine]

U.S. Production2023: 389,812 lb
Consumer UsesStabilizing agent
Industry UsesStabilizing agent
Use ClassificationCosmetics -> Buffering
General Manufacturing Information · 2 items

All Other Basic Organic Chemical Manufacturing

1-Butanol, 2-amino-: ACTIVE

Upstream & downstream products

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

Related reactions

84 records
New reaction record

Linked notes

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