Vitas-M small molecule compound

2-(4,5,6,7-tetrachloro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl hexanoate

Catalog ID
STK247383
SMILES CCCCCC(=O)Oc1ccccc1N1C(=O)c2c(C1=O)c(Cl)c(c(c2Cl)Cl)Cl

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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 C20H15Cl4NO4 MW 475.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl4NO4/c1-2-3-4-9-12(26)29-11-8-6-5-7-10(11)25-19(27)13-14(20(25)28)16(22)18(24)17(23)15(13)21/h5-8H,2-4,9H2,1H3
InChIKey
GDOPZQDHJZSBQR-UHFFFAOYSA-N
Synonyms

(2(4567tetrachloro13dioxoisoindol2yl)phenyl)hexanoate
2(4567tetrachloro13dioxo13dihydro2Hisoindol2yl)phenylhexanoate
CCCCCC(=O)OC1=CC=CC=C1N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl
InChI=1SC20H15Cl4NO4c1234912(26)2911865710(11)2519(27)1314(20(25)28)16(22)18(24)17(23)15(13)21h58H249H21H3
MFCD01174842
ZINC000004175650
ZINC04175650
ZINC4175650

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Available files

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