Vitas-M small molecule compound

methyl {7-[(3-bromobenzyl)oxy]-6-chloro-4-methyl-2-oxo-2H-chromen-3-yl}acetate

Catalog ID
STK829445
SMILES COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OCc1cccc(c1)Br)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 C20H16BrClO5 MW 451.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrClO5/c1-11-14-7-16(22)18(26-10-12-4-3-5-13(21)6-12)9-17(14)27-20(24)15(11)8-19(23)25-2/h3-7,9H,8,10H2,1-2H3
InChIKey
PZXHMWAOILRUKD-UHFFFAOYSA-N
Synonyms
573707-90-1
573707901
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC(=CC=C3)Br)CC(=O)OC
InChI=1SC20H16BrClO5c11114716(22)18(26101243513(21)612)917(14)2720(24)15(11)819(23)252h379H810H212H3
methyl(7((3bromobenzyl)oxy)6chloro4methyl2oxo2Hchromen3yl)acetate
methyl2(7((3bromobenzyl)oxy)6chloro4methyl2oxo2Hchromen3yl)acetate
METHYL2(7((3BROMOPHENYL)METHOXY)6CHLORO4METHYL2OXOCHROMEN3YL)ACETATE
MFCD04018226
ZINC000002445647
ZINC02445647
ZINC2445647

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Available files

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