Vitas-M small molecule compound

hexyl 2-(2,5-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK267925
SMILES CCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cc(C)ccc1C

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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 C23H25NO4 MW 379.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO4/c1-4-5-6-7-12-28-23(27)17-10-11-18-19(14-17)22(26)24(21(18)25)20-13-15(2)8-9-16(20)3/h8-11,13-14H,4-7,12H2,1-3H3
InChIKey
DMYQVDLOVKDOSO-UHFFFAOYSA-N
Synonyms

CCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=C(C=CC(=C3)C)C
hexyl2(25dimethylphenyl)13dioxo23dihydro1Hisoindole5carboxylate
HEXYL2(25DIMETHYLPHENYL)13DIOXOBENZO(C)AZOLINE5CARBOXYLATE
HEXYL2(25DIMETHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
InChI=1SC23H25NO4c14567122823(27)1710111819(1417)22(26)24(21(18)25)201315(2)8916(20)3h8111314H4712H213H3
MFCD01017591
ZINC000004113409
ZINC04113409
ZINC4113409

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Available files

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