기본 정보
- 표준 SMILES
Cc1ccn(-c2cc(Cl)ccc2C(O)C(F)(F)F)n1- InChIKey
YBMVIGVXVXAKDM-UHFFFAOYSA-N- 분자식
- C12H10ClF3N2O
- 평균 분자량
- 290.67 g/mol
이름 및 식별자
- 우선 이름
- 1-(4-Chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanol
- IUPAC
- 1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethanol
이름 및 동의어
1033805-20-71-(4-Chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanol1-[4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl]-2,2,2-trifluoroethan-1-ol4-Chloro-2-(3-methyl-1H-pyrazol-1-yl)-alpha-(trifluoromethyl)benzenemethanol1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethanol1-(4-chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethan-1-ol4-Chloro-2-(3-methyl-1H-pyrazol-1-yl)-|A-(trifluoromethyl)benzenemethanol(1R)-1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoroethanolSCHEMBL611965MFCD30188673AKOS030625322SB18027
이름 더 보기
SB18028SB49708CS-15626DB-190451CS-00432911-[4-chloro-2-(3-methyl-pyrazol-1-yl)-phenyl]-2,2,2-trifluoro-ethanol1-[4-chloro-2-(3-methylpyrazol-1-yl)phenyl]-2,2,2-trifluoro-ethanol4-Chloro-2-(3-methyl-1H-pyrazol-1-yl)--(trifluoromethyl)benzenemethanol
데이터베이스 식별자
- PubChem CID
- 25212415
물성
구조 계산 물성
- XLogP
- 3.2
- 극성 표면적
- 38.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 316
관련 반응
12건
화합물 노트
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