1-{4-Methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}ethan-1-one

HCID 9835518

기본 정보

CAS
447406-53-3
표준 SMILES
CC(=O)c1sc(-c2ccc(C(F)(F)F)cc2)nc1C
InChIKey
XIDURELJXRLATP-UHFFFAOYSA-N
분자식
C13H10F3NOS
평균 분자량
285.29 g/mol
단동위원소 질량
285.0435196

이름 및 식별자

우선 이름
1-{4-Methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}ethan-1-one
IUPAC
1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanone
영어명
1-[4-Methyl-2-(4-trifluoromethylphenyl)thiazol-5-yl]ethanone
분자식
C13H10F3NOS
분자량
285.28

이름 및 동의어

447406-53-31-{4-Methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}ethan-1-one1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]ethanone1-{4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}-1-ethanone1-[4-methyl-2-(4-trifluoromethylphenyl)thiazol-5-yl]ethanone1-(4-Methyl-2-(4-(trifluoromethyl)phenyl)thiazol-5-yl)ethan-1-one1-(4-METHYL-2-(4-(TRIFLUOROMETHYL)PHENYL)THIAZOL-5-YL)ETHANONE1-[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]ethanoneSCHEMBL4462657DTXSID00431512MFCD13243230AKOS008142830
이름 더 보기
Ethanone, 1-[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]-
DB-354000CS-02747258R-0817Z7355555781-[4-methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-yl]-ethanone

데이터베이스 식별자

CAS
447406-53-3
PubChem CID
9835518
DTXSID
DTXSID00431512

물성

구조 계산 물성

XLogP
3.9
극성 표면적
58.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
2
무거운 원자 수
19

물리화학적 성질

끓는 점
365 ℃ · 365℃
밀도
1.304 · 1.304
인화점
175 ℃ · 175℃
산도 계수 (pKa)
0.16 · 0.16±0.10(Predicted)

화학 및 산업

공급사3 곳

苏州岚云医药科技有限公司2332782371 · [email protected]
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]

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