2-Methoxybenzenesulfonyl Chloride

HCID 3745851

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 10130-87-7
표준 SMILES: COc1ccccc1S(=O)(=O)Cl
InChIKey: GYOBZOBUOMDRRN-UHFFFAOYSA-N
분자식: C7H7ClO3S
평균 분자량: 206.65 g/mol
단동위원소 질량: 205.98044276

이름 및 식별자

우선 이름: 2-Methoxybenzenesulfonyl Chloride
IUPAC: 2-methoxybenzenesulfonyl chloride
영어명: 2-METHOXYBENZENESULFONYL CHLORIDE
분자식: C7H7ClO3S
분자량: 206.65

이름 및 동의어

2-Methoxybenzenesulfonyl chloride10130-87-7DTXSID40395846RefChem:262744DTXCID70346705800-005-52-Methoxy-benzenesulfonyl chloride2-methoxybenzene-1-sulfonyl chlorideMFCD019613672-MethoxybenzenesulfonylchlorideBenzenesulfonyl chloride, 2-methoxy-2-methoxybenzenesulphonylchloride

이름 더 보기

AKOS BB-94652-Methoxyphenylsulfonyl chlorideo-Methoxybenzenesulfonyl chloride5-Methoxybenzenesulfonyl chloride2-Methoxybenzenesulphonyl chloride2-Methoxybenzenesulfonylchloride,97%M**2-METHOXYBENZENE SULFONYL CHLORIDE

CS-W007645AS-70322-METHOXYBENZENE SULFONYL CHLORIDE2-(methyloxy)benzenesulfonyl chlorideo-Anisolesulfonyl chloo-Anisolesulfonyl chlorideFT-0647552A897198

데이터베이스 식별자

CAS: 10130-87-7
PubChem CID: 3745851
DTXSID: DTXSID40395846
EC Number: 800-005-5、956-591-9
Nikkaji: J1.058.128A

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 51.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 232

물리화학적 성질

녹는점: 50 · 50-54°C
끓는 점: 126 · 126-129 °C(Press: 0.3 Torr)
밀도: 1.376 · 1.376
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
InChI: InChI=1S/C7H7ClO3S/c1-11-6-4-2-3-5-7(6)12(8,9)10/h2-5H,1H3
InChIKey: GYOBZOBUOMDRRN-UHFFFAOYSA-N
SMILES: C1(S(Cl)(=O)=O)=CC=CC=C1OC

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 25% (1 of 4) of reports.

Danger

H290 (25%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.