2-Amino-1-butanol (HCID 22129)

概要

structure

名称と識別子

優先名称: 2-Amino-1-butanol
IUPAC: 2-aminobutan-1-ol
現地名: rac-(R*)-2-アミノ-1-ブタノール
英語名: DL-2-Amino-1-butanol
分子式: C4H11NO
分子量: 89.14

名称と別名

2-Aminobutan-1-ol2-Amino-1-butanol96-20-82-Aminobutanol1-BUTANOL, 2-AMINO-2-Aminobutyl alcoholButanol-2-amine1-(Hydroxymethyl)propylamine2-Amino-1-hydroxybutaneN008Q02GPSNSC-1068DTXSID60859935

名称をさらに表示

rac-(R*)-2-アミノ-1-ブタノールrac-(R*)-2-アミノブタン-1-オールDL-2-アミノ-1-ブタノールrac-(S*)-2-アミノ-1-ブタノール(±)-2-アミノ-1-ブタノール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

データベース識別子

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

物性

構造計算による物性

XLogP: -0.4
極性表面積: 46.3 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 6
形式電荷: 0
複雑度: 30.7

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Amino Alcohols, Other

CosmeticsBuffering

SpringerMaterials PropertiesOptical coefficient

Vapor Pressure0.15 [mmHg]

Physical Description · 2 件

Liquid

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

物理化学的性質

融点: -2 °C · -2 °C(lit.)
沸点: 179 · 179-183 °C(lit.)
比重(密度): 0.944 g/mL · 0.944 g/mL at 20 °C(lit.)
屈折率: 20 · n20/D 1.452
闪点: 184 °F · 184 °F
InChI: InChI=1S/C4H11NO/c1-2-4(5)3-6/h4,6H,2-3,5H2,1H3
InChIKey: JCBPETKZIGVZRE-UHFFFAOYSA-N
SMILES: C(N)(CO)CC
CAS データベース: 13054 · 13054-87-0(CAS DataBase Reference)
NISTの化学物質情報: 1 · 1-Butanol, 2-amino-, (.+/-.)-(13054-87-0)
EPAの化学物質情報: 1 · 1-Butanol, 2-amino-(13054-87-0)

安全と法規制

GHS分類

GHS Classification · 6 件

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

危険有害性情報

Regulatory Information · 4 件

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 件

Skin Corr. 1C (100%)

Acute Tox. 4 (98.2%)

Acute toxicity - category 4

安全と保護具

Exposure Control and Personal Protection1.0 [ppm]

毒性情報

Adverse EffectsDermatotoxin - Skin burns.

安全データ

wgk: 2
rtecs: EK9625000
ridadr: UN 2735 8/PG 3
risk_code: 34
hazard_code: C
safety_code: 26-36/37/39-45
hazard_class: 8
packing_group: III

化学と産業

用途と製造

Uses · 2 件

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 件

All Other Basic Organic Chemical Manufacturing

1-Butanol, 2-amino-: ACTIVE