Vitas-M small molecule compound

2-(4-fluorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid

Catalog ID
STK778618
SMILES OC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccc(cc1)F)O2

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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 C15H12FNO4 MW 289.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12FNO4/c16-8-1-3-9(4-2-8)17-7-15-6-5-10(21-15)11(14(19)20)12(15)13(17)18/h1-6,10-12H,7H2,(H,19,20)
InChIKey
FFNNGZCWWSPFHR-UHFFFAOYSA-N
Synonyms
1005150-91-3
(6R7S7aR)2(4fluorophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylicacid
1005150913
2(4fluorophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylicacid
C1C23C=CC(O2)C(C3C(=O)N1C4=CC=C(C=C4)F)C(=O)O
InChI=1SC15H12FNO4c168139(428)177156510(2115)11(14(19)20)12(15)13(17)18h161012H7H2(H1920)
MFCD05856883
ZINC000100018551
ZINC000242473292

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.