Vitas-M small molecule compound
methyl (4-methyl-2-oxo-7-{[3-(trifluoromethyl)benzyl]oxy}-2H-chromen-3-yl)acetate
Catalog ID
STL460499
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OCc1cccc(c1)C(F)(F)F
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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 C21H17F3O5 MW 406.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F3O5/c1-12-16-7-6-15(9-18(16)29-20(26)17(12)10-19(25)27-2)28-11-13-4-3-5-14(8-13)21(22,23)24/h3-9H,10-11H2,1-2H3InChIKey
PVNZBNCHPPIRNT-UHFFFAOYSA-NSynonyms
692268-51-2692268512
CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=CC(=CC=C3)C(F)(F)F)CC(=O)OC
InChI=1SC21H17F3O5c112167615(918(16)2920(26)17(12)1019(25)272)28111343514(813)21(2223)24h39H1011H212H3
methyl(4methyl2oxo7((3(trifluoromethyl)benzyl)oxy)2Hchromen3yl)acetate
methyl2(4methyl2oxo7((3(trifluoromethyl)benzyl)oxy)2Hchromen3yl)acetate
METHYL2(4METHYL2OXO7((3(TRIFLUOROMETHYL)PHENYL)METHOXY)CHROMEN3YL)ACETATE
MFCD03720993
ZINC000001129762
ZINC01129762
ZINC1129762
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