Ethanethiol, 2-(diethylamino)-, hydrochloride (1:1)

HCID 16031CAS 1942-52-5

기본 정보

표준 SMILES: CCN(CC)CCS.Cl
InChIKey: QAXLTZBBDSDRPW-UHFFFAOYSA-N
분자식: C6H16ClNS
평균 분자량: 169.72 g/mol
단동위원소 질량: 169.06919819

이름 및 식별자

우선 이름: Ethanethiol, 2-(diethylamino)-, hydrochloride (1:1)
IUPAC: 2-(diethylamino)ethanethiol;hydrochloride

이름 및 동의어

2-Diethylaminoethanethiol hydrochloride1942-52-5Diethyl-2-mercaptoethylammonium chlorideUSAF E-4ETHANETHIOL, 2-(DIETHYLAMINO)-, HYDROCHLORIDEEINECS 217-731-8AI3-26086Ethanethiol, 2-(diethylamino)-, hydrochloride (1:1)DTXSID8062078(Diethylamino)ethanethiol hydrochlorideRefChem:591853DTXCID7036086

이름 더 보기

Diethyl2mercaptoethylammonium chlorideEthanethiol, 2(diethylamino), hydrochloride217-731-82-(diethylamino)ethanethiol hydrochloride2-(diethylamino)ethanethiol;hydrochloride185463-71-22-(diethylamino)ethane-1-thiol hydrochloride2-Diethylaminoethyl mercaptan hydrochloride

데이터베이스 식별자

CAS: 1942-52-5
PubChem CID: 16031
DTXSID: DTXSID8062078
UNII: TC4JV8V2VN
EC Number: 217-731-8

물성

구조 계산 물성

극성 표면적: 4.2 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 4
무거운 원자 수: 9
형식 전하: 0
복잡도: 43.8

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Sulfur Compounds

Physical DescriptionWhite crystalline solid with an unpleasant odor; [Aldrich MSDS]

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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.