Vitas-M small molecule compound

6-(phenylethynyl)-1H,3H-benzo[de]isochromene-1,3-dione

Catalog ID
STK533779
SMILES O=C1OC(=O)c2c3c1ccc(c3ccc2)C#Cc1ccccc1

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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 C20H10O3 MW 298.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H10O3/c21-19-16-8-4-7-15-14(10-9-13-5-2-1-3-6-13)11-12-17(18(15)16)20(22)23-19/h1-8,11-12H
InChIKey
KHGLEOCABXBLDW-UHFFFAOYSA-N
Synonyms

6(phenylethynyl)1H3Hbenzo(de)isochromene13dione
6(PHENYLETHYNYL)1H3HNAPHTHO(18CD)PYRAN13DIONE
6(phenylethynyl)benzo(de)isochromene13dione
C1=CC=C(C=C1)C#CC2=C3C=CC=C4C3=C(C=C2)C(=O)OC4=O
InChI=1SC20H10O3c2119168471514(109135213613)111217(18(15)16)20(22)2319h181112H
MFCD00393068
ZINC000097951037
ZINC97951037

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Available files

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