Vitas-M small molecule compound
1-(1,3-benzodioxol-5-yl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL143176
SMILES OC(=O)c1nnn(c1C)c1ccc2c(c1)OCO2
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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 C11H9N3O4 MW 247.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9N3O4/c1-6-10(11(15)16)12-13-14(6)7-2-3-8-9(4-7)18-5-17-8/h2-4H,5H2,1H3,(H,15,16)InChIKey
OOBITTXDOOFFAZ-UHFFFAOYSA-NSynonyms
1097050-86-61(13benzodioxol5yl)5methyl1H123triazole4carboxylicacid
1(13benzodioxol5yl)5methyltriazole4carboxylicacid
1097050866
CC1=C(N=NN1C2=CC3=C(C=C2)OCO3)C(=O)O
InChI=1SC11H9N3O4c1610(11(15)16)121314(6)72389(47)185178h24H5H21H3(H1516)
MFCD11540078
ZINC000037312235
ZINC37312235
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