5-[(4-CHLOROPHENOXY)METHYL]-1,2-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE

CAS号
113056-45-4
CCD编号
CCD03041308
分子式
C9 H8 Cl N3 O S
分子量
241.701

基本信息

产品名称: 5-[(4-CHLOROPHENOXY)METHYL]-1,2-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
CAS: 113056-45-4
英文同义词: 5-[(4-CHLOROPHENOXY)METHYL]-1,2-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE ; 5-(4-CHLORO-PHENOXYMETHYL)-4H-[1,2,4]TRIAZOLE-3-THIOL
MDL号: MFCD16661209
氢键受体数量: 4
氢键供体数量: 2
Smile: c1cc(ccc1OCc2[nH][nH]c(=S)n2)Cl
InChi: InChI=1S/C9H8ClN3OS/c10-6-1-3-7(4-2-6)14-5-8-11-9(15)13-12-8/h1-4H,5H2,(H2,11,12,13,15)
InChiKey: InChIKey=OIAHIKHIYQWBHQ-UHFFFAOYSA-N

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