Vitas-M small molecule compound

3,4,8-trimethyl-7-[2-oxo-2-(4-pentylphenyl)ethoxy]-2H-chromen-2-one

Catalog ID
STK716724
SMILES CCCCCc1ccc(cc1)C(=O)COc1ccc2c(c1C)oc(=O)c(c2C)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 C25H28O4 MW 392.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28O4/c1-5-6-7-8-19-9-11-20(12-10-19)22(26)15-28-23-14-13-21-16(2)17(3)25(27)29-24(21)18(23)4/h9-14H,5-8,15H2,1-4H3
InChIKey
CYRMKLRTUTUHKA-UHFFFAOYSA-N
Synonyms
374705-60-9
348trimethyl7(2oxo2(4pentylphenyl)ethoxy)2Hchromen2one
348TRIMETHYL7(2OXO2(4PENTYLPHENYL)ETHOXY)CHROMEN2ONE
374705609
CCCCCC1=CC=C(C=C1)C(=O)COC2=C(C3=C(C=C2)C(=C(C(=O)O3)C)C)C
InChI=1SC25H28O4c156781991120(121019)22(26)15282314132116(2)17(3)25(27)2924(21)18(23)4h914H5815H214H3
MFCD01881531
ZINC000002221814
ZINC02221814
ZINC2221814

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Available files

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