Vitas-M small molecule compound

1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(3-nitro-1H-pyrazol-1-yl)ethanone

Catalog ID
STK963981
SMILES FC(C1(O)CC(=NN1C(=O)Cn1ccc(n1)[N+](=O)[O-])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 C10H9F4N5O4 MW 339.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9F4N5O4/c11-8(12)5-3-10(21,9(13)14)18(15-5)7(20)4-17-2-1-6(16-17)19(22)23/h1-2,8-9,21H,3-4H2
InChIKey
BPXHKXKJVZETDU-UHFFFAOYSA-N
Synonyms
512826-41-4
1(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)2(3nitro1Hpyrazol1yl)ethanone
1(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)2(3NITROPYRAZOL1YL)ETHANONE
35BIS(DIFLUOROMETHYL)1((3NITRO1HPYRAZOL1YL)ACETYL)45DIHYDRO1HPYRAZOL5OL
512826414
C1C(=NN(C1(C(F)F)O)C(=O)CN2C=CC(=N2)(N+)(=O)(O))C(F)F
FC(C1(O)CC(=NN1C(=O)Cn1ccc(n1)(N+)(=O)(O))C(F)F)F
InChI=1SC10H9F4N5O4c118(12)5310(219(13)14)18(155)7(20)417216(1617)19(22)23h128921H34H2
MFCD03468804
ZINC000001012143
ZINC000001012144

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Available files

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