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기본 정보
- CAS
1254304-22-7- 표준 SMILES
COc1ccc(Cl)c(S(=O)(=O)NC(=O)c2cn3cc(C(F)(F)F)cc(Cl)c3n2)c1- InChIKey
PHCCDUCBMCYSNQ-UHFFFAOYSA-N- 분자식
- C16H10Cl2F3N3O4S
- 평균 분자량
- 468.2 g/mol
- 단동위원소 질량
- 466.9721169
이름 및 식별자
- 우선 이름
- Fluazaindolizine
- IUPAC
- 8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
이름 및 동의어
fluazaindolizine1254304-22-7SalibroWHQ8UEW6ZKCHEBI:87543DTXSID30894878RefChem:140790DTXCID301324438Fluazaindolizine [ISO]8-chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide8-Chloro-N-((2-chloro-5-methoxyphenyl)sulfonyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide((8-Chloro-N-(2-chloro-5-methoxyphenyl)sulfonyl)-6-trifluoromethyl)imidazo(1,2-a)pyridine-2-carboxamide
이름 더 보기
8-Chloro-N-((2-chloro-5-methoxyphenyl)sulfonyl)-6-(trifluoromethyl)imidazo(1,2-a)pyridine-2-carboxamide8-chloro-N-(2-chloro-5-methoxybenzene-1-sulfonyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamideImidazo(1,2-a)pyridine-2-carboxamide, 8-chloro-N-((2-chloro-5-methoxyphenyl)sulfonyl)-6-(trifluoromethyl)-Imidazo[1,2-a]pyridine-2-carboxamide, 8-chloro-N-[(2-chloro-5-methoxyphenyl)sulfonyl]-6-(trifluoromethyl)-UNII-WHQ8UEW6ZKSCHEMBL2681429SCHEMBL29361783EAC30422
데이터베이스 식별자
- CAS
1254304-22-7- PubChem CID
- 46944253
- DTXSID
DTXSID30894878- ChEBI
CHEBI:87543- UNII
- WHQ8UEW6ZK
- EC Number
- 832-861-0
- Nikkaji
- J3.498.430A
물성
구조 계산 물성보충 중
- XLogP
- 4.6
- 극성 표면적
- 98.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 721
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]；H411 (28.1%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]；H412 (49.1%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P260, P264, P270, P273, P301+P317, P319, P330, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 57 reports by companies from 3 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 CategoriesAcute Tox. 4 (100%)；STOT RE 2 (100%)；Aquatic Chronic 2 (28.1%)；Aquatic Chronic 3 (49.1%)
관련 반응
5건
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