Vitas-M small molecule compound
4-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoic acid
Catalog ID
STK298446
SMILES Cc1nn(c(c1)C)Cc1ccc(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 C13H14N2O2 MW 230.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O2/c1-9-7-10(2)15(14-9)8-11-3-5-12(6-4-11)13(16)17/h3-7H,8H2,1-2H3,(H,16,17)InChIKey
ORMOJZFLVSEQOR-UHFFFAOYSA-NSynonyms
312531-87-64((35DIMETHYL1HPYRAZOL1YL)METHYL)BENZOICACID
4((35DIMETHYL1HPYRAZOL2IUM1YL)METHYL)BENZOATE
4((35DIMETHYL1HPYRAZOL2IUM2YL)METHYL)BENZOATE
4((35DIMETHYLPYRAZOL1YL)METHYL)BENZOICACID
4((35DIMETHYLPYRAZOLYL)METHYL)BENZOICACID
4(35DIMETHYLPYRAZOL1YLMETHYL)BENZOICACID
CC1=CC(=(N+)(N1)CC2=CC=C(C=C2)C(=O)(O))C
InChI=1SC13H14N2O2c19710(2)15(149)8113512(6411)13(16)17h37H8H212H3(H1617)
ZINC52717
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