기본 정보
- CAS
641639-55-6- 표준 SMILES
COC(=O)c1cc(-c2ccc(SC)cc2)n(-c2ccc(C(F)(F)F)cc2)n1- InChIKey
KSGGVVZMQIRRLK-UHFFFAOYSA-N- 분자식
- C19H15F3N2O2S
- 평균 분자량
- 392.4 g/mol
- 단동위원소 질량
- 392.08063339
이름 및 식별자
- 우선 이름
- Methyl 1-(4-(trifluoromethyl)phenyl)-5-(4-(methylthio)phenyl)-1H-pyrazole-3-carboxylate
- IUPAC
- methyl 5-(4-methylsulfanylphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylate
- 영어명
- Methyl 5-(4-methylsulfanyl-phenyl)-1-(4-trifluoromethyl-phenyl)-1H-pyrazole-3-carboxylate
- 분자식
- C19H15F3N2O2S
- 분자량
- 392.39
이름 및 동의어
641639-55-6Methyl 1-(4-(trifluoromethyl)phenyl)-5-(4-(methylthio)phenyl)-1H-pyrazole-3-carboxylatemethyl 5-(4-(methylthio)phenyl)-1-(4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carboxylateMETHYL 5-(4-METHYLSULFANYL-PHENYL)-1-(4-TRIFLUOROMETHYL-PHENYL)-1H-PYRAZOLE-3-CARBOXYLATEMFCD04973408methyl 5-(4-methylsulfanylphenyl)-1-[4-(trifluoromethyl)phenyl]pyrazole-3-carboxylateMethyl 5-(4-methylsulfanylphenyl)-1-(4-trifluoromethyl-phenyl)-1H-pyrazole-3-carboxylateSCHEMBL3870911DTXSID80621499KSGGVVZMQIRRLK-UHFFFAOYSA-NAKOS027327744SB38093
이름 더 보기
1H-Pyrazole-3-carboxylic acid, 5-[4-(methylthio)phenyl]-1-[4-(trifluoromethyl)phenyl]-, methyl ester
1H-Pyrazole-3-carboxylicacid, 5-[4-(methylthio)phenyl]-1-[4-(trifluoromethyl)phenyl]-, methyl esterCS-0361876F471632methyl5-(4-(methylthio)phenyl)-1-(4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carboxylateMethyl 5-[4-(methylsulfanyl)phenyl]-1-[4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylate
물성
구조 계산 물성
- XLogP
- 5.1
- 극성 표면적
- 69.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 504
화학 및 산업
공급사5 곳
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
上海相辉医药科技有限公司[email protected]
上海智乾生物科技有限公司[email protected]
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