Vitas-M small molecule compound

5-methyl-3-nitro-1-[3-(trifluoromethyl)benzyl]-1H-pyrazole

Catalog ID
STK312683
SMILES [O-][N+](=O)c1nn(c(c1)C)Cc1cccc(c1)C(F)(F)F

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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 C12H10F3N3O2 MW 285.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10F3N3O2/c1-8-5-11(18(19)20)16-17(8)7-9-3-2-4-10(6-9)12(13,14)15/h2-6H,7H2,1H3
InChIKey
WNBCHMGMGMBDAU-UHFFFAOYSA-N
Synonyms
957400-33-8
(O)(N+)(=O)c1nn(c(c1)C)Cc1cccc(c1)C(F)(F)F
5METHYL3NITRO1((3(TRIFLUOROMETHYL)PHENYL)METHYL)PYRAZOLE
5methyl3nitro1(3(trifluoromethyl)benzyl)1Hpyrazole
5METHYL3NITRO1(3TRIFLUOROMETHYLBENZYL)1H
5METHYL3NITRO1(3TRIFLUOROMETHYLBENZYL)1HPYRAZOLE
957400338
CC1=CC(=NN1CC2=CC(=CC=C2)C(F)(F)F)(N+)(=O)(O)
InChI=1SC12H10F3N3O2c18511(18(19)20)1617(8)7932410(69)12(1314)15h26H7H21H3
MFCD02029415
ZINC000001059455
ZINC01059455
ZINC1059455

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Available files

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