Vitas-M small molecule compound

1-(3-methylbenzyl)-3-nitro-1H-pyrazole

Catalog ID
STK489645
SMILES Cc1cccc(c1)Cn1ccc(n1)[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 C11H11N3O2 MW 217.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O2/c1-9-3-2-4-10(7-9)8-13-6-5-11(12-13)14(15)16/h2-7H,8H2,1H3
InChIKey
FCZKJKHYRJYXBO-UHFFFAOYSA-N
Synonyms
956358-68-2
1((3METHYLPHENYL)METHYL)3NITROPYRAZOLE
1(3methylbenzyl)3nitro1Hpyrazole
956358682
CC1=CC(=CC=C1)CN2C=CC(=N2)(N+)(=O)(O)
Cc1cccc(c1)Cn1ccc(n1)(N+)(=O)(O)
InChI=1SC11H11N3O2c1932410(79)8136511(1213)14(15)16h27H8H21H3
MFCD05855766
ZINC000001426782
ZINC01426782
ZINC1426782

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Available files

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