Vitas-M small molecule compound

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

Catalog ID
STK922895
SMILES COC(=O)C(Oc1ccc2c(c1)occ(c2=O)Oc1ccccc1Br)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 C19H15BrO6 MW 419.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrO6/c1-11(19(22)23-2)25-12-7-8-13-16(9-12)24-10-17(18(13)21)26-15-6-4-3-5-14(15)20/h3-11H,1-2H3
InChIKey
GZAGNZKUXWDGQH-UHFFFAOYSA-N
Synonyms

CC(C(=O)OC)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Br
InChI=1SC19H15BrO6c111(19(22)232)2512781316(912)241017(18(13)21)2615643514(15)20h311H12H3
methyl2((3(2bromophenoxy)4oxo4Hchromen7yl)oxy)propanoate
METHYL2(3(2BROMOPHENOXY)4OXOCHROMEN7YL)OXYPROPANOATE
METHYL2(3(2BROMOPHENOXY)4OXOCHROMEN7YLOXY)PROPANOATE
MFCD02073139
ZINC000001129050
ZINC000001129051

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Available files

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