([3-CYANO-6-OXO-4-(TRIFLUOROMETHYL)-1,6-DIHYDROPYRIDIN-2-YL]THIO)ACETIC ACID

CAS号
852388-81-9
CCD编号
CCD00549284
分子式
C9 H5 F3 N2 O3 S
分子量
278.21

基本信息

产品名称: ([3-CYANO-6-OXO-4-(TRIFLUOROMETHYL)-1,6-DIHYDROPYRIDIN-2-YL]THIO)ACETIC ACID
CAS: 852388-81-9
英文同义词: 2-([3-CYANO-6-OXO-4-(TRIFLUOROMETHYL)-1,6-DIHYDROPYRIDIN-2-YL]SULFANYL)ACETIC ACID ; ([3-CYANO-6-OXO-4-(TRIFLUOROMETHYL)-1H-PYRIDIN-2-YL]SULFANYL)ACETIC ACID ; ([3-CYANO-6-OXO-4-(TRIFLUOROMETHYL)-1,6-DIHYDROPYRIDIN-2-YL]THIO)ACETIC ACID
MDL号: MFCD06655429
氢键受体数量: 5
氢键供体数量: 2
Smile: c1c(c(c([nH]c1=O)SCC(=O)O)C#N)C(F)(F)F
InChi: InChI=1S/C9H5F3N2O3S/c10-9(11,12)5-1-6(15)14-8(4(5)2-13)18-3-7(16)17/h1H,3H2,(H,14,15)(H,16,17)
InChiKey: InChIKey=BCKNFHHFPMZJJF-UHFFFAOYSA-N

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