2-아미노티오페놀

2-Aminothiophenol

HCID 8713CAS 137-07-5
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Nc1ccccc1S
InChIKey
VRVRGVPWCUEOGV-UHFFFAOYSA-N
분자식
C6H7NS
평균 분자량
125.19 g/mol
단동위원소 질량
125.02992022

개요

2-aminothiophenol is an aryl thiol that is thiophenol substituted at position 2 by an amino group. It has a role as a plant metabolite. It is a substituted aniline and an aryl thiol.

이름 및 식별자

우선 이름
2-Aminothiophenol
IUPAC
2-aminobenzenethiol
현지명
2-아미노티오페놀
영어명
2-Aminobenzenethiol
분자식
C6H7NS
분자량
125.19

이름 및 동의어

2-Aminothiophenol2-AMINOBENZENETHIOL137-07-5o-Aminothiophenol2-Mercaptoanilineo-Aminobenzenethiolo-MercaptoanilineBenzenethiol, 2-amino-2-Mercaptaniline1-Amino-2-mercaptobenzeneBenzenethiol, o-amino-o-Aminophenyl mercaptan
이름 더 보기
2-아미노벤젠티올2-아미노티오페놀1-아미노-2-머캅토벤젠2-머캅토아닐린2-싸이오아닐린2-아미노벤젠싸이올2-아미노싸이오페놀2-아미노-싸이오페놀2-아미노페닐 머캅탄o-머캅토아닐린알파-아미노싸이오페놀Aminothiophenol2-Aminoa-Ethyl pyrrole2-AMINOBENZENTHIOL2-mercaptonoanilineNSC 106635
2-Aminophenyl mercaptan2-Amino-1-mercaptobenzeneKIT82KOK2ZNSC-4738DTXSID6051693CHEBI:91019NSC-106635RefChem:465230

데이터베이스 식별자

CAS
137-07-5、40451-21-6
PubChem CID
8713
DTXSID
DTXSID6051693
ChEMBL
CHEMBL116835
ChEBI
CHEBI:91019
UNII
KIT82KOK2Z
EC Number
205-277-3
Nikkaji
J5.628F

물성

구조 계산 물성

XLogP
1.4
극성 표면적
27 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
2
회전 가능 결합 수
0
무거운 원자 수
8

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Sulfur Compounds
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Vapor Pressure0.02 [mmHg]
Physical DescriptionMelting point = 26 deg C; [ChemIDplus] Liquid with a stench; Sensitive to air; mp = 19-21 deg C; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
23 °C · 23 °C
끓는 점
70 · 70-72 °C0.2 mm Hg(lit.)
밀도
1.17 g/mL · 1.17 g/mL at 25 °C(lit.)
증기압
1 hPa · 1 hPa (69 °C)
굴절률
20 · n20/D 1.642(lit.)
인화점
175 °F · 175 °F

화학적 성질

clear yellow to amber liquid

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 97% (2010 of 2073) of all reports.

Not Classified

Aggregated GHS information provided per 2073 reports by companies from 15 notifications to the ECHA C&L Inventory.

Warning

H227: Combustible liquid [Warning Flammable liquids]

P210, P280, P370+P378, P403, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory Information · 3건

Chemical: Benzenethiol, 2-amino-

Status: Active Update: 15-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22901

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

Hazards Summary · 1건

Causes methemoglobinemia in oral lethal-dose studies of rats; [RTECS] Causes burns; May cause skin sensitization and methemoglobinemia; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Toxic by ingestion; May have cumulative effects; [Alfa Aesar MSDS] See 2-Aminophenol.

Hazard Classes and Categories · 2건

Not Classified

Flammable liquids - Category 4

독성 정보

Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
DC0600000
ridadr
UN 1760 8/PG 3
HS 번호
29309070
risk_code
22-34-50/53-37-20/21/22

화학 및 산업

용도 및 제조

UsesUsed for synthesis in the chemical industry; [IUCLID]
General Manufacturing InformationBenzenethiol, 2-amino-: ACTIVE

응용 분야

용도A multifunctional compound which shows antioxidant activity in a skin cell model of UVA-induced stress.

일반 설명2-Aminothiophenol couples with Amberlite XAD by means of an N=N spacer to prepare a new functionalized resin for on-line preconcentration of copper and cadmium.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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上海伟聂化工科技有限公司13046668259 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

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