Vitas-M small molecule compound

1-(2-fluorophenyl)-5-propyl-1H-1,2,3-triazole-4-carboxylic acid

Catalog ID
STL190733
SMILES CCCc1c(nnn1c1ccccc1F)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 C12H12FN3O2 MW 249.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12FN3O2/c1-2-5-10-11(12(17)18)14-15-16(10)9-7-4-3-6-8(9)13/h3-4,6-7H,2,5H2,1H3,(H,17,18)
InChIKey
LNCBIKRQIUXEOO-UHFFFAOYSA-N
Synonyms
1097117-78-6
1(2fluorophenyl)5propyl1H123triazole4carboxylicacid
1(2fluorophenyl)5propyltriazole4carboxylicacid
1097117786
CCCC1=C(N=NN1C2=CC=CC=C2F)C(=O)O
InChI=1SC12H12FN3O2c1251011(12(17)18)141516(10)974368(9)13h3467H25H21H3(H1718)
MFCD11540096
ZINC000037312296
ZINC37312296

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Available files

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