Vitas-M small molecule compound

decyl 2-(2,4-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK247196
SMILES CCCCCCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1C)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 C27H33NO4 MW 435.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO4/c1-4-5-6-7-8-9-10-11-16-32-27(31)21-13-14-22-23(18-21)26(30)28(25(22)29)24-15-12-19(2)17-20(24)3/h12-15,17-18H,4-11,16H2,1-3H3
InChIKey
MKKYDYZZUMRNHG-UHFFFAOYSA-N
Synonyms

CCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=C(C=C(C=C3)C)C
DECYL2(24DIMETHYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
DECYL2(24DIMETHYLPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
DECYL2(24DIMETHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
InChI=1SC27H33NO4c14567891011163227(31)2113142223(1821)26(30)28(25(22)29)24151219(2)1720(24)3h12151718H41116H213H3
MFCD01046539
ZINC000002062877
ZINC02062877
ZINC2062877

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Available files

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