기본 정보
- CAS
175202-28-5- 표준 SMILES
CC(C)S(=O)(=O)c1csc(C(=O)Cl)c1Cl- InChIKey
IECIGDCEDBXRTI-UHFFFAOYSA-N- 분자식
- C8H8Cl2O3S2
- 평균 분자량
- 287.2 g/mol
- 단동위원소 질량
- 285.9291918
이름 및 식별자
- 우선 이름
- 3-Chloro-4-(propane-2-sulfonyl)-thiophene-2-carbonyl chloride
- IUPAC
- 3-chloro-4-propan-2-ylsulfonylthiophene-2-carbonyl chloride
- 현지명
- 3-클로로-4-(이소프로필술포닐)티오펜-2-카르보닐염화물
- 영어명
- 3-Chloro-4-(isopropylsulfonyl)thiophene-2-carbonyl chloride
- 분자식
- C8H8Cl2O3S2
- 분자량
- 287.18
이름 및 동의어
3-chloro-4-(propane-2-sulfonyl)-thiophene-2-carbonyl chlorideRefChem:499927692-304-0175202-28-53-Chloro-4-(Isopropylsulfonyl)Thiophene-2-Carbonyl Chloride3-chloro-4-propan-2-ylsulfonylthiophene-2-carbonyl chlorideMFCD00084960C8H8Cl2O3S23-Chloro-4-(isopropylsulfonyl)thiophene-2-carbonylchloride3-chloro-4-(propane-2-sulfonyl)thiophene-2-carbonyl chloride2-Thiophenecarbonyl chloride, 3-chloro-4-[(1-methylethyl)sulfonyl]-IECIGDCEDBXRTI-UHFFFAOYSA-N
이름 더 보기
3-클로로-4-(이소프로필술포닐)티오펜-2-카르보닐염화물3-chloro-4-propan-2-ylsulfonyl-2-thiophenecarbonyl chloride3-chloro-4-(isopropylsulphonyl)thiophene-2-carbonyl chloride
SCHEMBL3065143DTXSID00381083AKOS015910716AS-5954DB-044083F3175303-chloro-4-(isopropylsulfonyl)-2-thiophenecarbonyl chloride3-chloro-4-isopropylsulfonyl-thiophene-2-carbonyl chloride
데이터베이스 식별자
물성
구조 계산 물성
- XLogP
- 3.1
- 극성 표면적
- 87.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 347
물리화학적 성질
- 녹는점
- 170 °C · 170 °C
- 끓는 점
- 444.9 · 444.9±45.0 °C(Predicted)
- 밀도
- 1.492 · 1.492±0.06 g/cm3(Predicted)
안전 및 규제
GHS 분류
GHS Classification
Warning
H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]；H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)
안전 데이터
- ridadr
- 3261
- risk_code
- 34
- safety_code
- 26-36/37/39
화학 및 산업
공급사2 곳
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
重庆卡兰医药有限公司[email protected]
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