Vitas-M small molecule compound

5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid

Catalog ID
STK343960
SMILES [O-][N+](=O)c1c(C)nn(c1C)Cc1ccc(o1)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 C11H11N3O5 MW 265.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O5/c1-6-10(14(17)18)7(2)13(12-6)5-8-3-4-9(19-8)11(15)16/h3-4H,5H2,1-2H3,(H,15,16)
InChIKey
WWNBPKPNFYJWDG-UHFFFAOYSA-N
Synonyms
380580-59-6
(O)(N+)(=O)c1c(C)nn(c1C)Cc1ccc(o1)C(=O)O
380580596
5((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)2FUROICACID
5((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)FURAN2CARBOXYLICACID
5((35DIMETHYL4NITROPYRAZOL1YL)METHYL)FURAN2CARBOXYLICACID
5((35DIMETHYL4NITROPYRAZOLYL)METHYL)FURAN2CARBOXYLICACID
5((4NITRO35DIMETHYL1HPYRAZOL1YL)METHYL)2FUROICACID
5(35DIMETHYL4NITROPYRAZOL1YLMETHYL)FURAN2CARBOXYLICACID
CC1=C(C(=NN1CC2=CC=C(O2)C(=O)O)C)(N+)(=O)(O)
InChI=1SC11H11N3O5c1610(14(17)18)7(2)13(126)58349(198)11(15)16h34H5H212H3(H1516)
MFCD02055870
ZINC000000812248
ZINC812248

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Available files

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