Vitas-M small molecule compound

3-methyl-4-nitro-1-(2,2,2-trifluoroethyl)-1H-pyrazole

Catalog ID
STL414638
SMILES [O-][N+](=O)c1cn(nc1C)CC(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 C6H6F3N3O2 MW 209.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H6F3N3O2/c1-4-5(12(13)14)2-11(10-4)3-6(7,8)9/h2H,3H2,1H3
InChIKey
KFFATVDPKIIPFY-UHFFFAOYSA-N
Synonyms
1245772-08-0
(O)(N+)(=O)c1cn(nc1C)CC(F)(F)F
1245772080
3methyl4nitro1(222trifluoroethyl)1Hpyrazole
3METHYL4NITRO1(222TRIFLUOROETHYL)PYRAZOLE
CC1=NN(C=C1(N+)(=O)(O))CC(F)(F)F
InChI=1SC6H6F3N3O2c145(12(13)14)211(104)36(78)9h2H3H21H3
MFCD16345412
ZINC000072334098
ZINC72334098

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Available files

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