Vitas-M small molecule compound
3,5-dimethyl-1-(2-methylbenzyl)-4-nitro-1H-pyrazole
Catalog ID
STK481844
SMILES Cc1ccccc1Cn1nc(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 C13H15N3O2 MW 245.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O2/c1-9-6-4-5-7-12(9)8-15-11(3)13(16(17)18)10(2)14-15/h4-7H,8H2,1-3H3InChIKey
YWJDLTISYMFUBG-UHFFFAOYSA-NSynonyms
35DIMETHYL1((2METHYLPHENYL)METHYL)4NITROPYRAZOLE
35dimethyl1(2methylbenzyl)4nitro1Hpyrazole
CC1=CC=CC=C1CN2C(=C(C(=N2)C)(N+)(=O)(O))C
Cc1ccccc1Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC13H15N3O2c19645712(9)81511(3)13(16(17)18)10(2)1415h47H8H213H3
MFCD06167692
ZINC000004820942
ZINC04820942
ZINC4820942
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