Vitas-M small molecule compound

2-(4-bromophenyl)-5-methylhexahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK252897
SMILES Brc1ccc(cc1)N1C(=O)C2C(C1=O)CC(CC2)C

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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 C15H16BrNO2 MW 322.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrNO2/c1-9-2-7-12-13(8-9)15(19)17(14(12)18)11-5-3-10(16)4-6-11/h3-6,9,12-13H,2,7-8H2,1H3
InChIKey
BZRNBPGTGIXIOM-UHFFFAOYSA-N
Synonyms

(3AS5R7AR)2(4BROMOPHENYL)5METHYLHEXAHYDRO1HISOINDOLE13(2H)DIONE
2(4bromophenyl)5methyl3a45677ahexahydroisoindole13dione
2(4bromophenyl)5methylhexahydro1Hisoindole13(2H)dione
CC1CCC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)Br
InChI=1SC15H16BrNO2c19271213(89)15(19)17(14(12)18)115310(16)4611h3691213H278H21H3
MFCD02020288
ZINC000018241232
ZINC000101889069

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Available files

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