Vitas-M small molecule compound

methyl 5-(4-fluorophenyl)-1-nitroso-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate

Catalog ID
STL240657
SMILES COC(=O)C1=NN(C2C1C(=O)N(C2=O)c1ccc(cc1)F)N=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 C13H9FN4O5 MW 320.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9FN4O5/c1-23-13(21)9-8-10(18(15-9)16-22)12(20)17(11(8)19)7-4-2-6(14)3-5-7/h2-5,8,10H,1H3
InChIKey
XKHMORBPEMNJAJ-UHFFFAOYSA-N
Synonyms
1008209-38-8
1008209388
COC(=O)C1=NN(C2C1C(=O)N(C2=O)C3=CC=C(C=C3)F)N=O
InChI=1SC13H9FN4O5c12313(21)9810(18(159)1622)12(20)17(11(8)19)7426(14)357h25810H1H3
methyl5(4fluorophenyl)1nitroso46dioxo13a4566ahexahydropyrrolo(34c)pyrazole3carboxylate
METHYL5(4FLUOROPHENYL)1NITROSO46DIOXO3A6ADIHYDROPYRROLO(34C)PYRAZOLE3CARBOXYLATE
MFCD03685186
ZINC000005053634
ZINC000101000461

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Available files

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