Vitas-M small molecule compound

ethyl 2-{[4-methyl-3-(3-methylbutyl)-2-oxo-2H-chromen-7-yl]oxy}propanoate

Catalog ID
STK997795
SMILES CCOC(=O)C(Oc1ccc2c(c1)oc(=O)c(c2C)CCC(C)C)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 C20H26O5 MW 346.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26O5/c1-6-23-19(21)14(5)24-15-8-10-16-13(4)17(9-7-12(2)3)20(22)25-18(16)11-15/h8,10-12,14H,6-7,9H2,1-5H3
InChIKey
OIJYVDPIXJLOFZ-UHFFFAOYSA-N
Synonyms
376385-30-7
376385307
CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(C)C)C
ethyl2((3isopentyl4methyl2oxo2Hchromen7yl)oxy)propanoate
ethyl2((4methyl3(3methylbutyl)2oxo2Hchromen7yl)oxy)propanoate
ETHYL2(4METHYL3(3METHYLBUTYL)2OXOCHROMEN7YL)OXYPROPANOATE
InChI=1SC20H26O5c162319(21)14(5)24158101613(4)17(9712(2)3)20(22)2518(16)1115h8101214H679H215H3
MFCD02311383
ZINC000000217524
ZINC000000217529

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Available files

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