기본 정보
- 표준 SMILES
COC(=O)C(O)(C(F)(F)F)C(F)(F)F- InChIKey
GZNNMGJAIPPJBM-UHFFFAOYSA-N- 분자식
- C5H4F6O3
- 평균 분자량
- 226.07 g/mol
이름 및 식별자
- 우선 이름
- Methyl 3,3,3-trifluoro-2-hydroxy-2-trifluoromethylpropionate
- IUPAC
- methyl 3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoate
이름 및 동의어
7594-51-6Methyl 3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoatemethyl 3,3,3-trifluoro-2-hydroxy-2-trifluoromethylpropionateMFCD011173362-Hydroxy-2-trifluoromethyl-3,3,3-trifluoropropionic Acid Methyl Ester;starbld0009937SCHEMBL867202SY382991G73863F553796methyl 2-hydroxy-3,3,3-trifluoro-2-trifluoromethylpropionateMethyl 333-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoate
이름 더 보기
2-hydroxy-3,3,3-trifluoro-2-trifluoromethylpropionic acid methyl esterMethyl 3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoate (ACI)Propanoic acid, 3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)-, methyl ester
데이터베이스 식별자
- PubChem CID
- 9877912
- Nikkaji
- J2.383.108B
물성
구조 계산 물성
- XLogP
- 1.5
- 극성 표면적
- 46.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 215
관련 반응
8건
연결된 노트
불러오는 중…