Vitas-M small molecule compound

[5-(difluoromethyl)-5-hydroxy-3-methyl-4,5-dihydro-1H-pyrazol-1-yl](4-nitrophenyl)methanone

Catalog ID
STK430944
SMILES FC(C1(O)CC(=NN1C(=O)c1ccc(cc1)[N+](=O)[O-])C)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 C12H11F2N3O4 MW 299.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11F2N3O4/c1-7-6-12(19,11(13)14)16(15-7)10(18)8-2-4-9(5-3-8)17(20)21/h2-5,11,19H,6H2,1H3
InChIKey
ZCEDHCKYIZJNMQ-UHFFFAOYSA-N
Synonyms

(5(difluoromethyl)5hydroxy3methyl45dihydro1Hpyrazol1yl)(4nitrophenyl)methanone
(5(DIFLUOROMETHYL)5HYDROXY3METHYL4HPYRAZOL1YL)(4NITROPHENYL)METHANONE
5(DIFLUOROMETHYL)5HYDROXY3METHYL(2PYRAZOLINYL)4NITROPHENYLKETONE
CC1=NN(C(C1)(C(F)F)O)C(=O)C2=CC=C(C=C2)(N+)(=O)(O)
FC(C1(O)CC(=NN1C(=O)c1ccc(cc1)(N+)(=O)(O))C)F
InChI=1SC12H11F2N3O4c17612(1911(13)14)16(157)10(18)8249(538)17(20)21h251119H6H21H3
MFCD03470100
ZINC000006755531
ZINC000006755544

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Available files

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