Vitas-M small molecule compound

2-(1,3-benzodioxol-5-yl)-5-bromo-1H-isoindole-1,3(2H)-dione

Catalog ID
STK375909
SMILES Brc1ccc2c(c1)C(=O)N(C2=O)c1ccc2c(c1)OCO2

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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 C15H8BrNO4 MW 346.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H8BrNO4/c16-8-1-3-10-11(5-8)15(19)17(14(10)18)9-2-4-12-13(6-9)21-7-20-12/h1-6H,7H2
InChIKey
PDBQJUQHEXYTCQ-UHFFFAOYSA-N
Synonyms
355829-52-6
2(13benzodioxol5yl)5bromo1Hisoindole13(2H)dione
2(13BENZODIOXOL5YL)5BROMOISOINDOLE13DIONE
2(2HBENZO(34D)13DIOXOLAN5YL)5BROMOBENZO(C)AZOLIDINE13DIONE
355829526
C1OC2=C(O1)C=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)Br
InChI=1SC15H8BrNO4c168131011(58)15(19)17(14(10)18)9241213(69)2172012h16H7H2
MFCD01348097
ZINC000004151130
ZINC04151130
ZINC4151130

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Available files

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