기본 정보
- CAS
317319-27-0- 표준 SMILES
Cc1nc(-c2ccc(C(F)(F)F)c(F)c2)sc1CO- InChIKey
SSJKNJYBSHISNC-UHFFFAOYSA-N- 분자식
- C12H9F4NOS
- 평균 분자량
- 291.27 g/mol
- 단동위원소 질량
- 291.03409773
이름 및 식별자
- 우선 이름
- (2-(3-Fluoro-4-(trifluoromethyl)phenyl)-4-methylthiazol-5-yl)methanol
- IUPAC
- [2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazol-5-yl]methanol
- 영어명
- 2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-hydroxymethyl thiazole
- 분자식
- C12H9F4NOS
- 분자량
- 291.26
이름 및 동의어
317319-27-0(2-(3-Fluoro-4-(trifluoromethyl)phenyl)-4-methylthiazol-5-yl)methanol2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-hydroxymethyl Thiazole{2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazol-5-yl}methanol[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazol-5-yl]methanolMFCD073694165-(Hydroxymethyl)-2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazole(2-(3-fluoro-4-(trifluoromethyl)phenyl)-4-methyl-1,3-thiazol-5-yl)methanolC12H9F4NOSSCHEMBL5017176DTXSID00594813AKOS005072956
이름 더 보기
2-[3-Fluoro-4-(trifluoroMethyl)phenyl]-4-Methyl-5-thiazoleMethanol5-Thiazolemethanol, 2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-(2-[3-FLUORO-4-(TRIFLUOROMETHYL)PHENYL]-4-METHYL-1,3-THIAZOL-5-YL)METHANOL5-(Aminomethyl)-2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-1,3-thiazole
HA-0834DB-260573CS-0450944[2-(3-fluoro-4-trifluoromethyl-phenyl)-4-methyl-thiazol-5-yl]-methanol[2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-methyl-thiazol-5-yl]methanol
데이터베이스 식별자
- CAS
317319-27-0- PubChem CID
- 18526219
- DTXSID
DTXSID00594813
물성
구조 계산 물성
- XLogP
- 3.1
- 극성 표면적
- 61.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 315
물리화학적 성질
- 녹는점
- 159 · 159-161
- 저장 조건
- 2 · 2-8°C
- 용해도
- 클로로포름(약간 용해됨), 에틸아세테이트(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 색상
- 황백색에서 연한 노란색
화학적 성질
Off-White Solid
안전 및 규제
안전 데이터
- HS 번호
- 2934100090
- hazard_code
- Xi
- 위험 등급
- IRRITANT
화학 및 산업
응용 분야
용도2-[3-Fluoro-4-(trifluoromethyl)phenyl]-4-methyl-5-hydroxymethyl Thiazole (cas# 317319-27-0) is a compound useful in organic synthesis.
공급사10 곳
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