Vitas-M small molecule compound

2-[(4-nitro-1H-pyrazol-1-yl)methyl]benzoic acid

Catalog ID
STK312097
SMILES [O-][N+](=O)c1cnn(c1)Cc1ccccc1C(=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 C11H9N3O4 MW 247.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9N3O4/c15-11(16)10-4-2-1-3-8(10)6-13-7-9(5-12-13)14(17)18/h1-5,7H,6H2,(H,15,16)
InChIKey
VZAQMWCFGKUZAB-UHFFFAOYSA-N
Synonyms
925145-56-8
(O)(N+)(=O)c1cnn(c1)Cc1ccccc1C(=O)O
2((4nitro1Hpyrazol1yl)methyl)benzoicacid
2((4NITROPYRAZOL1YL)METHYL)BENZOICACID
2((4NITROPYRAZOLYL)METHYL)BENZOICACID
2(4NITROPYRAZOL1YLMETHYL)BENZOICACID
925145568
C1=CC=C(C(=C1)CN2C=C(C=N2)(N+)(=O)(O))C(=O)O
InChI=1SC11H9N3O4c1511(16)1042138(10)61379(51213)14(17)18h157H6H2(H1516)
MFCD04969107
ZINC000002536940
ZINC2536940

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Available files

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