4-클로로-2,5-디메틸벤젠술포닐염화물

5-Chloro-p-xylene-2-sulphonyl chloride

HCID 66618

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 88-49-3
표준 SMILES: Cc1cc(S(=O)(=O)Cl)c(C)cc1Cl
InChIKey: JBYZPUBAISWVDI-UHFFFAOYSA-N
분자식: C8H8Cl2O2S
평균 분자량: 239.12 g/mol
단동위원소 질량: 237.96220586

이름 및 식별자

우선 이름: 5-Chloro-p-xylene-2-sulphonyl chloride
IUPAC: 4-chloro-2,5-dimethylbenzenesulfonyl chloride
현지명: 4-클로로-2,5-디메틸벤젠술포닐염화물
영어명: 4-Chloro-2,5-dimethylbenzenesulfonyl chloride
분자식: C8H8Cl2O2S
분자량: 239.12

이름 및 동의어

88-49-34-chloro-2,5-dimethylbenzenesulfonyl chloride5-Chloro-p-xylene-2-sulphonyl chlorideEINECS 201-835-5DTXSID80236749RefChem:534943DTXCID60159240201-835-54-chloro-2,5-dimethylbenzene-1-sulfonyl chlorideBenzenesulfonylchloride, 4-chloro-2,5-dimethyl-MFCD000440174-chloro-2,5-dimethyl-benzenesulfonyl chloride

이름 더 보기

4-클로로-2,5-디메틸벤젠술포닐염화물ORO-2,5-DIMETHYLBENZENESULFONYL CHLORIDE4-CHLORO-2,5-DIMETHYLBENZENESULPHONYL CHLORIDE4-CHLORO-2,5-DIMETHYLBENZENESULFONYL CHLORIDE4-CHLORO-2,5-DIMETHYLBENZENESULPHONYL CHLORIDE

chloro(4-chloro-2,5-dimethylphenyl)sulfone4-Chloro-2,5-dimethylbenzenesulfonylchlorideFY2BCA5XT7Benzenesulfonyl chloride, 4-chloro-2,5-dimethyl-SCHEMBL152556SCHEMBL29707985AAA08849SBB066486

데이터베이스 식별자

CAS: 88-49-3
PubChem CID: 66618
DTXSID: DTXSID80236749
UNII: FY2BCA5XT7
EC Number: 201-835-5
Nikkaji: J192.656J

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 42.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 270

물리화학적 성질

녹는점: 48 °C · 48 °C
끓는 점: 317.5 · 317.5±42.0 °C(Predicted)
밀도: 1.401 · 1.401±0.06 g/cm3(Predicted)
BRN: 2838165 · 2838165

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 2 notifications to the ECHA C&L Inventory.