Vitas-M small molecule compound
ethyl 3-{7-[(4-bromo-2-fluorobenzyl)oxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoate
Catalog ID
STL463320
SMILES CCOC(=O)CCc1c(=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 C23H22BrFO5 MW 477.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrFO5/c1-4-28-21(26)10-8-18-13(2)17-7-9-20(14(3)22(17)30-23(18)27)29-12-15-5-6-16(24)11-19(15)25/h5-7,9,11H,4,8,10,12H2,1-3H3InChIKey
CTDHONQXQVVWRJ-UHFFFAOYSA-NSynonyms
858746-03-9858746039
CCOC(=O)CCC1=C(C2=C(C(=C(C=C2)OCC3=C(C=C(C=C3)Br)F)C)OC1=O)C
ethyl3(7((4bromo2fluorobenzyl)oxy)48dimethyl2oxo2Hchromen3yl)propanoate
ETHYL3(7((4BROMO2FLUOROPHENYL)METHOXY)48DIMETHYL2OXOCHROMEN3YL)PROPANOATE
InChI=1SC23H22BrFO5c142821(26)1081813(2)177920(14(3)22(17)3023(18)27)2912155616(24)1119(15)25h57911H481012H213H3
MFCD03850659
ZINC000002146910
ZINC02146910
ZINC2146910
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