Vitas-M small molecule compound
5-methyl-1-(4-methylbenzyl)-3-nitro-1H-pyrazole
Catalog ID
STK489642
SMILES Cc1ccc(cc1)Cn1nc(cc1C)[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 C12H13N3O2 MW 231.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O2/c1-9-3-5-11(6-4-9)8-14-10(2)7-12(13-14)15(16)17/h3-7H,8H2,1-2H3InChIKey
UUTHNVKYNNJEHI-UHFFFAOYSA-NSynonyms
5methyl1((4methylphenyl)methyl)3nitropyrazole
5methyl1(4methylbenzyl)3nitro1Hpyrazole
CC1=CC=C(C=C1)CN2C(=CC(=N2)(N+)(=O)(O))C
Cc1ccc(cc1)Cn1nc(cc1C)(N+)(=O)(O)
InChI=1SC12H13N3O2c193511(649)81410(2)712(1314)15(16)17h37H8H212H3
MFCD02029409
ZINC000020367434
ZINC20367434
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