Vitas-M small molecule compound

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

Catalog ID
STL178100
SMILES O=C(N1N=CCC1(O)C(F)(F)F)c1ccc(cc1)[N+](=O)[O-]

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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 C11H8F3N3O4 MW 303.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8F3N3O4/c12-11(13,14)10(19)5-6-15-16(10)9(18)7-1-3-8(4-2-7)17(20)21/h1-4,6,19H,5H2
InChIKey
VQGOKTVOAMBNNA-UHFFFAOYSA-N
Synonyms
832142-30-0
(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)(4nitrophenyl)methanone
(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)(4nitrophenyl)methanone
5HYDROXY5(TRIFLUOROMETHYL)(2PYRAZOLINYL)4NITROPHENYLKETONE
832142300
C1C=NN(C1(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC11H8F3N3O4c1211(1314)10(19)561516(10)9(18)7138(427)17(20)21h14619H5H2
MFCD04136780
O=C(N1N=CCC1(O)C(F)(F)F)c1ccc(cc1)(N+)(=O)(O)
ZINC000006926288
ZINC000006926289

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Available files

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