[1,1'-Biphenyl]-2-carboxylic acid, 6-methyl-4'-(trifluoromethyl)-
기본 정보
- CAS
256397-61-2- 표준 SMILES
Cc1cccc(C(=O)O)c1-c1ccc(C(F)(F)F)cc1- InChIKey
MVUGBURUWNYPHI-UHFFFAOYSA-N- 분자식
- C15H11F3O2
- 평균 분자량
- 280.24 g/mol
- 단동위원소 질량
- 280.07111408
이름 및 식별자
- 우선 이름
- [1,1'-Biphenyl]-2-carboxylic acid, 6-methyl-4'-(trifluoromethyl)-
- IUPAC
- 3-methyl-2-[4-(trifluoromethyl)phenyl]benzoic acid
이름 및 동의어
256397-61-2[1,1'-Biphenyl]-2-carboxylic acid, 6-methyl-4'-(trifluoromethyl)-6-methyl-4'-(trifluoromethyl)biphenyl-2-carboxylic acidSCHEMBL135115SCHEMBL29979402DTXSID60449355MVUGBURUWNYPHI-UHFFFAOYSA-MMVUGBURUWNYPHI-UHFFFAOYSA-N6-methyl-4'-trifluoromethyl-1,1'-biphenyl-2-carboxylic acid6-methyl-4'-trifluoromethyl-biphenyl-2-carboxylic acid6-methyl-4'-(trifluoromethyl)-1,1'-biphenyl-2-carboxylic acid6-methyl-4'-trifluoromethyl- 1,1'-biphenyl-2-carboxylic acid
이름 더 보기
6-Methyl-4'-(trifluoromethyl)[1,1'-biphenyl]-2-carboxylic acid
데이터베이스 식별자
- CAS
256397-61-2- PubChem CID
- 10945826
- DTXSID
DTXSID60449355
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 37.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 346
관련 반응
10건
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