Vitas-M small molecule compound

butyl [(6-chloro-4-methyl-2-oxo-3-propyl-2H-chromen-7-yl)oxy]acetate

Catalog ID
STK713364
SMILES CCCCOC(=O)COc1cc2oc(=O)c(c(c2cc1Cl)C)CCC

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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 C19H23ClO5 MW 366.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23ClO5/c1-4-6-8-23-18(21)11-24-17-10-16-14(9-15(17)20)12(3)13(7-5-2)19(22)25-16/h9-10H,4-8,11H2,1-3H3
InChIKey
PBFXOEUWFXBGRN-UHFFFAOYSA-N
Synonyms
307549-38-8
307549388
butyl((6chloro4methyl2oxo3propyl2Hchromen7yl)oxy)acetate
butyl2((6chloro4methyl2oxo3propyl2Hchromen7yl)oxy)acetate
BUTYL2(6CHLORO4METHYL2OXO3PROPYLCHROMEN7YL)OXYACETATE
CCCCOC(=O)COC1=C(C=C2C(=C(C(=O)OC2=C1)CCC)C)Cl
InChI=1SC19H23ClO5c14682318(21)112417101614(915(17)20)12(3)13(752)19(22)2516h910H4811H213H3
MFCD01540211
ZINC000001797591
ZINC01797591
ZINC1797591

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Available files

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