기본 정보
- CAS
438577-62-9- 표준 SMILES
Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(C)O- InChIKey
SVYRQELBDSYTBO-UHFFFAOYSA-N- 분자식
- C13H12F3NOS
- 평균 분자량
- 287.3 g/mol
- 단동위원소 질량
- 287.05916967
이름 및 식별자
- 우선 이름
- 1-[4-Methyl-2-(4-trifluoromethylphenyl)thiazol-5-yl]ethanol
- IUPAC
- 1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanol
- 영어명
- 1-[4-Methyl-2-(4-trifluoromethylphenyl)thiazol-5-yl]ethanol
- 분자식
- C13H12F3NOS
- 분자량
- 287.3
이름 및 동의어
438577-62-91-[4-methyl-2-(4-trifluoromethylphenyl)thiazol-5-yl]ethanol1-(4-METHYL-2-(4-(TRIFLUOROMETHYL)PHENYL)THIAZOL-5-YL)ETHANOL1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanolSCHEMBL3371882DTXSID50627307AKOS015918117DB-3539991-(4-Methyl-2-(4-(trifluoromethyl)phenyl)thiazol-5-yl)ethan-1-ol1-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl-]-ethanol1-[4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-ethanol[rac]-1-[4-methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-ethanol
이름 더 보기
5-Thiazolemethanol, α,4-dimethyl-2-[4-(trifluoromethyl)phenyl]-(R,S)-1-[4-methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-ethanol
1-{4-Methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}ethan-1-ol
데이터베이스 식별자
- CAS
438577-62-9- PubChem CID
- 22647631
- DTXSID
DTXSID50627307
물성
구조 계산 물성
- XLogP
- 3.5
- 극성 표면적
- 61.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 305
물리화학적 성질
- 끓는 점
- 379.45 · 379.450±52.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.316 · 1.316
- 산도 계수 (pKa)
- 13.543 · 13.543±0.20(predicted)
화학 및 산업
공급사3 곳
관련 반응
11건
화합물 노트
불러오는 중…