Vitas-M small molecule compound
1-(4-fluorobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
Catalog ID
STK349003
SMILES Fc1ccc(cc1)Cn1nc(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 C12H12FN3O2 MW 249.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12FN3O2/c1-8-12(16(17)18)9(2)15(14-8)7-10-3-5-11(13)6-4-10/h3-6H,7H2,1-2H3InChIKey
LCSLSZSYPNNJLW-UHFFFAOYSA-NSynonyms
512810-16-11((4FLUOROPHENYL)METHYL)35DIMETHYL4NITROPYRAZOLE
1(4fluorobenzyl)35dimethyl4nitro1Hpyrazole
1(4FLUOROBENZYL)4NITRO35DIMETHYL1HPYRAZOLE
512810161
CC1=C(C(=NN1CC2=CC=C(C=C2)F)C)(N+)(=O)(O)
Fc1ccc(cc1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC12H12FN3O2c1812(16(17)18)9(2)15(148)7103511(13)6410h36H7H212H3
MFCD03074545
ZINC000000373467
ZINC00373467
ZINC373467
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