[(4-클로로-2,5-디메틸페닐)티오]아세트산

Acetic acid, 2-((4-chloro-2,5-dimethylphenyl)thio)-

HCID 66739

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 93-77-6
표준 SMILES: Cc1cc(SCC(=O)O)c(C)cc1Cl
InChIKey: OEEPIGFTISQIKQ-UHFFFAOYSA-N
분자식: C10H11ClO2S
평균 분자량: 230.71 g/mol
단동위원소 질량: 230.01682827

이름 및 식별자

우선 이름: Acetic acid, 2-((4-chloro-2,5-dimethylphenyl)thio)-
IUPAC: 2-(4-chloro-2,5-dimethylphenyl)sulfanylacetic acid
현지명: [(4-클로로-2,5-디메틸페닐)티오]아세트산
영어명: [(4-chloro-2,5-dimethylphenyl)thio]acetic acid
분자식: C10H11ClO2S
분자량: 230.71

이름 및 동의어

EINECS 202-274-9Acetic acid, ((4-chloro-2,5-dimethylphenyl)thio)-Acetic acid, [(4-chloro-2,5-dimethylphenyl)thio]-Acetic acid, 2-((4-chloro-2,5-dimethylphenyl)thio)-Acetic acid, 2-[(4-chloro-2,5-dimethylphenyl)thio]-RefChem:55207193-77-6[(4-Chloro-2,5-dimethylphenyl)thio]acetic acid2-((4-Chloro-2,5-dimethylphenyl)thio)acetic acid[(4-chloro-2,5-dimethylphenyl)sulfanyl]acetic acid2-(4-chloro-2,5-dimethylphenyl)sulfanylacetic acidMFCD00027386

이름 더 보기

[(4-클로로-2,5-디메틸페닐)티오]아세트산2,5-dimethyl-4-chlorophenylmercaptoacetic acid2-(4-chloro-2,5-dimethyl-phenyl)sulfanylethanoic acid

((4-Chloro-2,5-dimethylphenyl)thio)acetic acid2-[(4-chloro-2,5-dimethylphenyl)sulfanyl]acetic acid[(4-chloro-2,5-dimethylphenyl)thio]aceticacidSCHEMBL91674422-(4-CHLORO-2,5-DIMETHYLPHENYLTHIO)ACETIC ACIDDTXSID9059090AKOS016009500TS-03285

데이터베이스 식별자

CAS: 93-77-6
PubChem CID: 66739
DTXSID: DTXSID9059090
EC Number: 202-274-9
Nikkaji: J182.096F

물성

구조 계산 물성

XLogP: 3.4
극성 표면적: 62.6 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 14
형식 전하: 0
복잡도: 210

물리화학적 성질

녹는점: 196 °C · 196 °C
끓는 점: 355.3 · 355.3±42.0 °C(Predicted)
밀도: 1.31 · 1.31±0.1 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
산도 계수 (pKa): 3.41 · 3.41±0.10(Predicted)
EPA: Acetic acid, [(4-chloro-2,5-dimethylphenyl)thio]- (93-77-6)

안전 및 규제

안전 데이터

tsca: TSCA listed

화학 및 산업

용도 및 제조

General Manufacturing InformationAcetic acid, 2-[(4-chloro-2,5-dimethylphenyl)thio]-: INACTIVE

상·하류 제품 정보

하류 제품

Vat Voilet 3

공급사4 곳

Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]

Alfa Chemistry+1-5166625404 · [email protected]

Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]

DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

화합물 노트

불러오는 중…