1-Mercapto-2-propanol

HCID 102545CAS 1068-47-9

기본 정보

표준 SMILES: CC(O)CS
InChIKey: FETFXNFGOYOOSP-UHFFFAOYSA-N
분자식: C3H8OS
평균 분자량: 92.16 g/mol
단동위원소 질량: 92.02958588

이름 및 식별자

우선 이름: 1-Mercapto-2-propanol
IUPAC: 1-sulfanylpropan-2-ol
영어명: 1-Mercapto-2-propanol
분자식: C3H8OS
분자량: 92.16

이름 및 동의어

1-Mercapto-2-propanol1-Mercaptopropan-2-ol2-Propanol, 1-mercapto-EINECS 213-946-6DTXSID80893058RefChem:433420DTXCID901323002213-946-61-Sulfanylpropan-2-ol1068-47-9MFCD00004878mercapto-2-propanol

이름 더 보기

3-Mercapto-2-propanol3-Mercaptopropane-2-ol2-HYDROXY-1-PROPANETHIOL1-Mercapto-2-propanol 95%1-MERCAPTO-2-PROPANOL 95+%

1-Mercapto-propan-2-olSCHEMBL154444SCHEMBL246003SCHEMBL3668996SCHEMBL6036973SCHEMBL84707641-Mercapto-2-propanol, 95%AKOS015912547

데이터베이스 식별자

CAS: 1068-47-9
PubChem CID: 102545
DTXSID: DTXSID80893058
EC Number: 213-946-6
Nikkaji: J60.723A

물성

구조 계산 물성

XLogP: 0.3
극성 표면적: 21.2 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 5
형식 전하: 0
복잡도: 22.9

물리화학적 성질

끓는 점: 58 · 58-60 °C/17 mmHg (lit.)
밀도: 1.048 g/mL · 1.048 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.486(lit.)
인화점: 145 °F · 145 °F
저장 조건: 2 · 2-8°C, stored under nitrogen
물리적 상태: liquid
InChI: 1S/C3H8OS/c1-3(4)2-5/h3-5H,2H2,1H3
InChIKey: FETFXNFGOYOOSP-UHFFFAOYSA-N
SMILES: CC(O)CS
LogP: 0.12 · 0.120 (est)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information2-Propanol, 1-mercapto-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
ridadr: UN 3334
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36/37/39
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야

용도1-Mercapto-2-propanol can be used as a self-assembled monolayer on the gold surfaces with potential use in electrochemical applications. It may also be used as a chiral agent which can be used in the chemical analysis of enantiomers.

일반 설명1-Mercapto-2-propanol is a chain transferring agent that is the sixth series of hydrogen bonded 1,2-propanols which can be used to form polymeric chains with low molecular weight and short chain length.