기본 정보
- 표준 SMILES
O=C(Cl)c1cc(C(F)(F)F)nn1-c1ncccc1Cl- InChIKey
HVIPOZXDKOWYGV-UHFFFAOYSA-N- 분자식
- C10H4Cl2F3N3O
- 평균 분자량
- 310.06 g/mol
- 단동위원소 질량
- 308.9683516
이름 및 식별자
- 우선 이름
- 1-(3-chloro-2-pyridinyl)-3-(trifluoromethyl)-1H-pyrazole-5-carbonyl Chloride
- IUPAC
- 1-(3-chloro-2-pyridinyl)-3-(trifluoromethyl)pyrazole-5-carbonyl chloride
이름 및 동의어
1-(3-chloro-2-pyridinyl)-3-(trifluoromethyl)-1H-pyrazole-5-carbonyl ChlorideSCHEMBL114535SCHEMBL30863652DB-1265351-(3-chloro-2-pyridinyl)-3-trifluoromethyl-1H-pyrazole-5-carbonyl chloride2-(3-chloro-2-pyridyI)-5-(trifluoromethyl)pyrazole-3-carbonyl chloride2-(3-chloro-2-pyridyl)-5-(trifluoromethyl)-pyrazole-3-carbonyl chloride2-(3-chloro-2-pyridyl)-5-(trifluoromethyl)pyrazole-3-carbonyl chloride2-(3-Chloropyridin-2-yl)-5-trifluoromethyl-2H-pyrazole-3-carbonyl chloride2-(3-chloro-pyridin-2-yl)-5-trifluoro methyl-2h-pyrazole-3-carbonyl chloride2-(3-chloro-pyridin-2-yl)-5-trifluoromethyl-2H-pyrazole-3-carbonyl chloride930785-94-7
데이터베이스 식별자
- PubChem CID
- 18446928
물성
구조 계산 물성
- XLogP
- 3.5
- 극성 표면적
- 47.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 355
관련 반응
49건
화합물 노트
불러오는 중…