Vitas-M small molecule compound
1-(3-methoxybenzyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL143203
SMILES COc1cccc(c1)Cn1nnc(c1C)C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H13N3O3 MW 247.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O3/c1-8-11(12(16)17)13-14-15(8)7-9-4-3-5-10(6-9)18-2/h3-6H,7H2,1-2H3,(H,16,17)InChIKey
FVHZNYHBOIHKTF-UHFFFAOYSA-NSynonyms
1266821-43-51((3methoxyphenyl)methyl)5methyltriazole4carboxylicacid
1(3methoxybenzyl)5methyl1H123triazole4carboxylicacid
1266821435
CC1=C(N=NN1CC2=CC(=CC=C2)OC)C(=O)O
InChI=1SC12H13N3O3c1811(12(16)17)131415(8)7943510(69)182h36H7H212H3(H1617)
MFCD17023588
ZINC000050215189
ZINC50215189
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