Vitas-M small molecule compound

methyl {7-[(3-bromobenzyl)oxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}acetate

Catalog ID
STL460395
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)OCc1cccc(c1)Br

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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 C21H19BrO5 MW 431.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrO5/c1-12-16-7-8-18(26-11-14-5-4-6-15(22)9-14)13(2)20(16)27-21(24)17(12)10-19(23)25-3/h4-9H,10-11H2,1-3H3
InChIKey
JFPZWVRSCSBYMN-UHFFFAOYSA-N
Synonyms
858750-56-8
858750568
CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC(=CC=C3)Br)CC(=O)OC
InChI=1SC21H19BrO5c112167818(26111454615(22)914)13(2)20(16)2721(24)17(12)1019(23)253h49H1011H213H3
methyl(7((3bromobenzyl)oxy)48dimethyl2oxo2Hchromen3yl)acetate
methyl2(7((3bromobenzyl)oxy)48dimethyl2oxo2Hchromen3yl)acetate
METHYL2(7((3BROMOPHENYL)METHOXY)48DIMETHYL2OXOCHROMEN3YL)ACETATE
MFCD03851990
ZINC000002092317
ZINC02092317
ZINC2092317

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Available files

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