5-Chloro-2-methoxybenzene-1-sulfonyl chloride

HCID 2734272

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 22952-32-5
표준 SMILES: COc1ccc(Cl)cc1S(=O)(=O)Cl
InChIKey: FCJGLIMDVOTBLO-UHFFFAOYSA-N
분자식: C7H6Cl2O3S
평균 분자량: 241.09 g/mol
단동위원소 질량: 239.9414706

이름 및 식별자

우선 이름: 5-Chloro-2-methoxybenzene-1-sulfonyl chloride
IUPAC: 5-chloro-2-methoxybenzenesulfonyl chloride
영어명: 5-Chloro-2-methoxybenzenesulfonyl chloride
분자식: C7H6Cl2O3S
분자량: 241.09

이름 및 동의어

5-chloro-2-methoxybenzene-1-sulfonyl chlorideRefChem:534584679-164-65-chloro-2-methoxybenzenesulfonyl chloride22952-32-5Benzenesulfonyl chloride, 5-chloro-2-methoxy-MFCD00052959chloro(5-chloro-2-methoxyphenyl)sulfone5-chloro-2-methoxyphenylsulfonyl chloride5-Chloro-2 Methoxybenzenesulfonyl Chloride5-chloro-2-methoxy-benzenesulfonyl ChlorideSCHEMBL750886

이름 더 보기

C7H6CL2O4SASISCHEM D48924BUTTPARK 49\07-554-Chloro-2-(chlorosulphonyl)anisole5-Chloro-2-methoxy-benzenesulfonyl c5-HLORO-2-METHOXYBENZENESULFONYL CHLORIDE3-Chloro-6-methoxybenzenesulfonyl chloride5-Chloro-2-methoxybenzenesulphonyl chloride

DTXSID60370190FCJGLIMDVOTBLO-UHFFFAOYSA-NALBB-005981STR04718SBB048019STK409592AKOS000264972CS-W012798

데이터베이스 식별자

CAS: 22952-32-5
PubChem CID: 2734272
DTXSID: DTXSID60370190
EC Number: 679-164-6

물성

구조 계산 물성

XLogP: 2.5
극성 표면적: 51.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 259

물리화학적 성질

녹는점: 100 · 100-104 °C
끓는 점: 344.6 · 344.6±32.0 °C(Predicted)
밀도: 1.487 · 1.487±0.06 g/cm3(Predicted)
저장 조건: Inert atmosphere,Room Temperature
물리적 상태: powder to crystal
색상: White to Orange to Green

화학적 성질

white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H290 (14.3%): May be corrosive to metals [Warning Corrosive to Metals]；H302 (28.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (28.6%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (14.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H332 (28.6%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P390, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesMet. Corr. 1 (14.3%)；Acute Tox. 4 (28.6%)；Acute Tox. 4 (28.6%)；Skin Corr. 1B (100%)；Eye Dam. 1 (14.3%)；Acute Tox. 4 (28.6%)