Vitas-M small molecule compound

1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole

Catalog ID
STK302373
SMILES Fc1cccc(c1Cn1nc(c(c1C)[N+](=O)[O-])C)Cl

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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 C12H11ClFN3O2 MW 283.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11ClFN3O2/c1-7-12(17(18)19)8(2)16(15-7)6-9-10(13)4-3-5-11(9)14/h3-5H,6H2,1-2H3
InChIKey
OSCBSQATNAVZAI-UHFFFAOYSA-N
Synonyms
333444-51-2
1((2CHLORANYL6FLUORANYLPHENYL)METHYL)35DIMETHYL4NITROPYRAZOLE
1((2CHLORO6FLUOROPHENYL)METHYL)35DIMETHYL4NITROPYRAZOLE
1(2chloro6fluorobenzyl)35dimethyl4nitro1Hpyrazole
1(2CHLORO6FLUOROBENZYL)35DIMETHYL4NITROPYRAZOLE
1(2CHLORO6FLUOROBENZYL)4NITRO35DIMETHYL1HPYRAZOLE
333444512
CC1=C(C(=NN1CC2=C(C=CC=C2Cl)F)C)(N+)(=O)(O)
Fc1cccc(c1Cn1nc(c(c1C)(N+)(=O)(O))C)Cl
InChI=1SC12H11ClFN3O2c1712(17(18)19)8(2)16(157)6910(13)43511(9)14h35H6H212H3
MFCD02575857
ZINC000000380112
ZINC00380112
ZINC380112

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Available files

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