Vitas-M small molecule compound

3-[1-(4-chlorophenyl)-3-oxobutyl]-2-oxo-2H-chromen-4-olate

Catalog ID
STK367944
SMILES CC(=O)CC(c1c(=O)oc2c(c1[O-])cccc2)c1ccc(cc1)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 C19H14ClO4 MW 341.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClO4/c1-11(21)10-15(12-6-8-13(20)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,22H,10H2,1H3/p-1
InChIKey
DEKWZWCFHUABHE-UHFFFAOYSA-M
Synonyms

3(1(4chlorophenyl)3oxobutyl)2oxo2Hchromen4olate
CC(=O)CC(c1c(=O)oc2c(c1(O))cccc2)c1ccc(cc1)Cl
MFCD00012094
ZINC000100030917
ZINC000100030921

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Available files

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