1-[4-Methyl-2-(4-trifluoromethylphenyl)thiazol-5-yl]ethanol

HCID 22647631

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

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

南京克罗托鲁宁医药科技有限公司13382066392
重庆卡兰医药有限公司[email protected]
南京世洲生物科技有限公司17301488900 · [email protected]

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