1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID, 1-(4-ACETYLPHENYL), METHYL ESTER

CAS No.
91397-40-9
CCD No.
CCD02006773
Formula
C12 H11 N3 O3
MolWeight
245.237

Basic Information

Product Name: 1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID, 1-(4-ACETYLPHENYL), METHYL ESTER
CAS: 91397-40-9
English Synonyms: 1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID, 1-(4-ACETYLPHENYL), METHYL ESTER ; METHYL 1-(4-ACETYLPHENYL)-1H-1,2,4-TRIAZOLE-3-CARBOXYLATE
MDL Number.: MFCD13191565
H bond acceptor: 6
H bond donor: 0
Smile: CC(=O)c1ccc(cc1)n2cnc(n2)C(=O)OC
InChi: InChI=1S/C12H11N3O3/c1-8(16)9-3-5-10(6-4-9)15-7-13-11(14-15)12(17)18-2/h3-7H,1-2H3
InChiKey: InChIKey=AUEZYWAWSOXLEA-UHFFFAOYSA-N

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