Vitas-M small molecule compound

1-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

Catalog ID
STL139308
SMILES COc1ccc(cc1)n1nnc(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 C11H11N3O3 MW 233.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O3/c1-7-10(11(15)16)12-13-14(7)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H,15,16)
InChIKey
IYWFMFVCWDZXMJ-UHFFFAOYSA-N
Synonyms
31802-54-7
1(4METHOXYPHENYL)5METHYL123TRIAZOLE4CARBOXYLICACID
1(4METHOXYPHENYL)5METHYL1H(123)TRIAZOLE4CARBOXYLICACID
1(4methoxyphenyl)5methyl1H123triazole4carboxylicacid
1(4METHOXYPHENYL)5METHYLTRIAZOLE4CARBOXYLICACID
31802547
CC1=C(N=NN1C2=CC=C(C=C2)OC)C(=O)O
InChI=1SC11H11N3O3c1710(11(15)16)121314(7)8359(172)648h36H12H3(H1516)
MFCD01566093
ZINC000000138627
ZINC138627

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.