Vitas-M small molecule compound
methyl {7-[(4-bromo-2-fluorobenzyl)oxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}acetate
Catalog ID
STL460388
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccc(cc1F)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 C21H18BrFO5 MW 449.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrFO5/c1-11-15-6-7-18(27-10-13-4-5-14(22)8-17(13)23)12(2)20(15)28-21(25)16(11)9-19(24)26-3/h4-8H,9-10H2,1-3H3InChIKey
ZBOBBMTXBFDVEZ-UHFFFAOYSA-NSynonyms
701953-73-3701953733
CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=C(C=C(C=C3)Br)F)CC(=O)OC
InChI=1SC21H18BrFO5c111156718(2710134514(22)817(13)23)12(2)20(15)2821(25)16(11)919(24)263h48H910H213H3
methyl(7((4bromo2fluorobenzyl)oxy)48dimethyl2oxo2Hchromen3yl)acetate
methyl2(7((4bromo2fluorobenzyl)oxy)48dimethyl2oxo2Hchromen3yl)acetate
METHYL2(7((4BROMO2FLUOROPHENYL)METHOXY)48DIMETHYL2OXOCHROMEN3YL)ACETATE
MFCD03851567
ZINC000001119927
ZINC01119927
ZINC1119927
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