1-[(3,5-DIMETHYLPHENYL)METHYL]-5-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID

CAS号
CCD编号
CCD03688568
分子式
C13 H15 N3 O2
分子量
245.281

基本信息

产品名称: 1-[(3,5-DIMETHYLPHENYL)METHYL]-5-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
英文同义词: 1-[(3,5-DIMETHYLPHENYL)METHYL]-5-METHYL-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
MDL号: MFCD17434756
氢键受体数量: 5
氢键供体数量: 1
Smile: Cc1cc(cc(c1)Cn2c(c(nn2)C(=O)O)C)C
InChi: InChI=1S/C13H15N3O2/c1-8-4-9(2)6-11(5-8)7-16-10(3)12(13(17)18)14-15-16/h4-6H,7H2,1-3H3,(H,17,18)
InChiKey: InChIKey=AKRKBRFTNLRARU-UHFFFAOYSA-N

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