Vitas-M small molecule compound
3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzoic acid
Catalog ID
STK346645
SMILES [O-][N+](=O)c1c(C)nn(c1C)Cc1cccc(c1)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 C13H13N3O4 MW 275.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O4/c1-8-12(16(19)20)9(2)15(14-8)7-10-4-3-5-11(6-10)13(17)18/h3-6H,7H2,1-2H3,(H,17,18)InChIKey
JJKZCGLFVALIHV-UHFFFAOYSA-NSynonyms
400752-48-9(O)(N+)(=O)c1c(C)nn(c1C)Cc1cccc(c1)C(=O)O
3((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)BENZENECARBOXYLICACID
3((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)BENZOICACID
3((35DIMETHYL4NITROPYRAZOL1YL)METHYL)BENZOICACID
3((35DIMETHYL4NITROPYRAZOLYL)METHYL)BENZOICACID
3((4NITRO35DIMETHYL1HPYRAZOL1YL)METHYL)BENZOICACID
3(35DIMETHYL4NITROPYRAZOL1YLMETHYL)BENZOICACID
400752489
CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)O)C)(N+)(=O)(O)
InChI=1SC13H13N3O4c1812(16(19)20)9(2)15(148)71043511(610)13(17)18h36H7H212H3(H1718)
MFCD00850618
ZINC000000368468
ZINC368468
Check stock
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Check stock on Vitas-MAvailable files
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