1-(3-METHYLBUTYL)-3-(THIOPHEN-3-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID

CAS号
CCD编号
CCD03691720
分子式
C13 H16 N2 O2 S
分子量
264.347

基本信息

产品名称: 1-(3-METHYLBUTYL)-3-(THIOPHEN-3-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
英文同义词: 1-(3-METHYLBUTYL)-3-(THIOPHEN-3-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
MDL号: MFCD17438017
氢键受体数量: 4
氢键供体数量: 1
Smile: CC(C)CCn1cc(c(n1)c2ccsc2)C(=O)O
InChi: InChI=1S/C13H16N2O2S/c1-9(2)3-5-15-7-11(13(16)17)12(14-15)10-4-6-18-8-10/h4,6-9H,3,5H2,1-2H3,(H,16,17)
InChiKey: InChIKey=VXEOJDCGKQKKCN-UHFFFAOYSA-N

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