Vitas-M small molecule compound
tert-butyl {[3-(4-bromophenyl)-4-methyl-2-oxo-2H-chromen-6-yl]oxy}acetate
Catalog ID
STL033930
SMILES O=C(OC(C)(C)C)COc1ccc2c(c1)c(C)c(c(=O)o2)c1ccc(cc1)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 C22H21BrO5 MW 445.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrO5/c1-13-17-11-16(26-12-19(24)28-22(2,3)4)9-10-18(17)27-21(25)20(13)14-5-7-15(23)8-6-14/h5-11H,12H2,1-4H3InChIKey
LSOLFOWFGCQKAN-UHFFFAOYSA-NSynonyms
CC1=C(C(=O)OC2=C1C=C(C=C2)OCC(=O)OC(C)(C)C)C3=CC=C(C=C3)Br
InChI=1SC22H21BrO5c113171116(261219(24)2822(23)4)91018(17)2721(25)20(13)145715(23)8614h511H12H214H3
MFCD05940429
tertbutyl((3(4bromophenyl)4methyl2oxo2Hchromen6yl)oxy)acetate
tertbutyl2(3(4bromophenyl)4methyl2oxochromen6yl)oxyacetate
TERTBUTYL2(3(4BROMOPHENYL)4METHYL2OXOCHROMEN6YLOXY)ACETATE
ZINC000011866275
ZINC11866275
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