Vitas-M small molecule compound

methyl 1-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazole-3-carboxylate

Catalog ID
STK349496
SMILES COC(=O)c1ccn(n1)Cn1nc(c(c1C)[N+](=O)[O-])C

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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 C11H13N5O4 MW 279.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N5O4/c1-7-10(16(18)19)8(2)15(12-7)6-14-5-4-9(13-14)11(17)20-3/h4-5H,6H2,1-3H3
InChIKey
FVFNEILDZPGANZ-UHFFFAOYSA-N
Synonyms
1006437-94-0
1006437940
CC1=C(C(=NN1CN2C=CC(=N2)C(=O)OC)C)(N+)(=O)(O)
COC(=O)c1ccn(n1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC11H13N5O4c1710(16(18)19)8(2)15(127)614549(1314)11(17)203h45H6H213H3
methyl1((35dimethyl4nitro1Hpyrazol1yl)methyl)1Hpyrazole3carboxylate
methyl1((35dimethyl4nitropyrazol1yl)methyl)pyrazole3carboxylate
METHYL1((35DIMETHYL4NITROPYRAZOLYL)METHYL)PYRAZOLE3CARBOXYLATE
MFCD04969140
ZINC000002536967
ZINC02536967
ZINC2536967

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.