Vitas-M small molecule compound

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

Catalog ID
STK305425
SMILES COC(=O)c1ccn(n1)Cn1ncc(c1)[N+](=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 C9H9N5O4 MW 251.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9N5O4/c1-18-9(15)8-2-3-12(11-8)6-13-5-7(4-10-13)14(16)17/h2-5H,6H2,1H3
InChIKey
IDILVTLKIXJDFI-UHFFFAOYSA-N
Synonyms
1005696-77-4
1005696774
COC(=O)C1=NN(C=C1)CN2C=C(C=N2)(N+)(=O)(O)
COC(=O)c1ccn(n1)Cn1ncc(c1)(N+)(=O)(O)
InChI=1SC9H9N5O4c1189(15)82312(118)61357(41013)14(16)17h25H6H21H3
methyl1((4nitro1Hpyrazol1yl)methyl)1Hpyrazole3carboxylate
METHYL1((4NITROPYRAZOL1YL)METHYL)PYRAZOLE3CARBOXYLATE
METHYL1((4NITROPYRAZOLYL)METHYL)PYRAZOLE3CARBOXYLATE
MFCD04050627
ZINC000002786203
ZINC02786203
ZINC2786203

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Available files

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