Vitas-M small molecule compound
3-(4-tert-butylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3,6-dichloro-2-methoxybenzoate
Catalog ID
STL056647
SMILES COc1c(Cl)ccc(c1C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)C(C)(C)C)C(F)(F)F)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 C28H21Cl2F3O6 MW 581.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21Cl2F3O6/c1-27(2,3)14-5-7-15(8-6-14)37-24-22(34)17-10-9-16(13-20(17)39-25(24)28(31,32)33)38-26(35)21-18(29)11-12-19(30)23(21)36-4/h5-13H,1-4H3InChIKey
IRZNHYJEJARYLZ-UHFFFAOYSA-NSynonyms
(3(4TERTBUTYLPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)36DICHLORO2METHOXYBENZOATE
3(4(tertbutyl)phenoxy)4oxo2(trifluoromethyl)4Hchromen7yl36dichloro2methoxybenzoate
3(4(TERTBUTYL)PHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL36DICHLORO2METHOXYBENZOATE
3(4tertbutylphenoxy)4oxo2(trifluoromethyl)4Hchromen7yl36dichloro2methoxybenzoate
CC(C)(C)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=C(C=CC(=C4OC)Cl)Cl)C(F)(F)F
InChI=1SC28H21Cl2F3O6c127(23)145715(8614)372422(34)1710916(1320(17)3925(24)28(3132)33)3826(35)2118(29)111219(30)23(21)364h513H14H3
MFCD02081451
ZINC000001772095
ZINC01772095
ZINC1772095
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