Vitas-M small molecule compound

1-(2-chloro-4-fluorobenzyl)-5-methyl-3-nitro-1H-pyrazole

Catalog ID
STK312999
SMILES Fc1ccc(c(c1)Cl)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 C11H9ClFN3O2 MW 269.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9ClFN3O2/c1-7-4-11(16(17)18)14-15(7)6-8-2-3-9(13)5-10(8)12/h2-5H,6H2,1H3
InChIKey
PIYDKJYCNSFOKG-UHFFFAOYSA-N
Synonyms
1004643-55-3
1((2CHLORO4FLUOROPHENYL)METHYL)5METHYL3NITROPYRAZOLE
1(2CHLORO4FLUOROBENZYL)5METHYL3NITRO1H
1(2chloro4fluorobenzyl)5methyl3nitro1Hpyrazole
1004643553
CC1=CC(=NN1CC2=C(C=C(C=C2)F)Cl)(N+)(=O)(O)
Fc1ccc(c(c1)Cl)Cn1nc(cc1C)(N+)(=O)(O)
InChI=1SC11H9ClFN3O2c17411(16(17)18)1415(7)68239(13)510(8)12h25H6H21H3
MFCD04970015
ZINC000002537790
ZINC02537790
ZINC2537790

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Available files

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