기본 정보
- CAS
306936-53-8- 표준 SMILES
COC(=O)c1ccc(S(=O)(=O)Cl)n1C- InChIKey
AKPDQZQBPBSNPS-UHFFFAOYSA-N- 분자식
- C7H8ClNO4S
- 평균 분자량
- 237.66 g/mol
- 단동위원소 질량
- 236.98625642
이름 및 식별자
- 우선 이름
- Methyl 5-(chlorosulfonyl)-1-methyl-1H-pyrrole-2-carboxylate
- IUPAC
- methyl 5-chlorosulfonyl-1-methylpyrrole-2-carboxylate
- 현지명
- 메틸5-(클로로술포닐)-1-메틸-1H-피롤-2-카르복실레이트
- 영어명
- Methyl 5-(chlorosulfonyl)-1-methyl-1H-pyrrole-2-carboxylate
- 분자식
- C7H8ClNO4S
- 분자량
- 237.66
이름 및 동의어
306936-53-8METHYL 5-(CHLOROSULFONYL)-1-METHYL-1H-PYRROLE-2-CARBOXYLATEMFCD02180789methyl 5-chlorosulfonyl-1-methylpyrrole-2-carboxylate1H-Pyrrole-2-carboxylic acid, 5-(chlorosulfonyl)-1-methyl-, methyl esterMethyl 5-(chlorosulphonyl)-1-methyl-1H-pyrrole-2-carboxylatemethyl 5-(chlorosulfonyl)-1-methylpyrrole-2-carboxylateSCHEMBL393117AKPDQZQBPBSNPS-UHFFFAOYSA-NDTXSID501189468SBB098853AKOS006221840
이름 더 보기
메틸5-(클로로술포닐)-1-메틸-1H-피롤-2-카르복실레이트1-METHYL-1H-PYRROLE-2-SULFONYL CHLORIDEMETHYL 5-CHLOROSULPHONYL-1-METHYLPYRROLE-2-CARBOXYLATEmethyl 5-chlorosulfonyl-1-methyl-pyrrole-2-carboxylate5-Chlorosulfonyl-1-methyl-2-pyrrolecarboxylicacidmethylester5-Chlorosulfonyl-1-methyl-2-pyrrolecarboxylic acid methyl es...1H-Pyrrole-2-carboxylicacid,5-(chlorosulfonyl)-1-methyl-,methylester(9CI)5-(Ethoxycarbonyl)-1-methyl-1H-pyrrole-2-sulphonyl chloride, 2-(Chlorosulphonyl)-5-(methoxycarbonyl)-1-methyl-1H-pyrrole
SB62143AS-31431CS-0151220EN300-271086F2263235-chlorosulfonyl-1-methyl-1H-pyrrole-2-carboxylic acid methyl esterMETHYL-5-(CHLOROSULFONYL)-1-METHYL-1H-PYRROLE-2-CARBOXYLATEMETHYL5-(CHLOROSULFONYL)-1-METHYL-1H-PYRROLE-2-CARBOXYLATE
물성
구조 계산 물성
- XLogP
- 1.2
- 극성 표면적
- 73.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 323
물리화학적 성질
- 녹는점
- 79 °C · 79 °C
- 끓는 점
- 364.9 · 364.9±27.0 °C(Predicted)
- 밀도
- 1.49 · 1.49±0.1 g/cm3(Predicted)
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- 산도 계수 (pKa)
- -19.28 · -19.28±0.70(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- ridadr
- 3261
- HS 번호
- 2933998090
- risk_code
- 34-36
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- 위험 참고 사항
- Irritant
화학 및 산업
공급사20 곳
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海相辉医药科技有限公司13761987713 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
上海伯倚化工科技有限公司021-54096810 18017263450 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
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