Vitas-M small molecule compound
4-(4-ethyl-3-methyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)benzoic acid
Catalog ID
STK627985
SMILES CCc1c(C)[nH]n(c1=O)c1ccc(cc1)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 C13H14N2O3 MW 246.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O3/c1-3-11-8(2)14-15(12(11)16)10-6-4-9(5-7-10)13(17)18/h4-7,14H,3H2,1-2H3,(H,17,18)InChIKey
XFCKZWHAZBREHU-UHFFFAOYSA-NSynonyms
897547-13-64(4ethyl3methyl5oxo25dihydro1Hpyrazol1yl)benzoicacid
4(4ETHYL5HYDROXY3METHYLPYRAZOL1YL)BENZOICACID
4(4ETHYL5METHYL3OXO1HPYRAZOL2YL)BENZOICACID
897547136
CCC1=C(NN(C1=O)C2=CC=C(C=C2)C(=O)O)C
CCc1c(C)(nH)n(c1=O)c1ccc(cc1)C(=O)O
InChI=1SC13H14N2O3c13118(2)1415(12(11)16)10649(5710)13(17)18h4714H3H212H3(H1718)
MFCD09790787
ZINC000040415125
ZINC40415125
ZINC4985167
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Check stock on Vitas-MAvailable files
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