Vitas-M small molecule compound

3-(4-iodophenoxy)-8-methyl-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl acetate

Catalog ID
STK529988
SMILES CC(=O)Oc1ccc2c(c1C)oc(c(c2=O)Oc1ccc(cc1)I)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 C19H12F3IO5 MW 504.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F3IO5/c1-9-14(26-10(2)24)8-7-13-15(25)17(18(19(20,21)22)28-16(9)13)27-12-5-3-11(23)4-6-12/h3-8H,1-2H3
InChIKey
XFGVUGJKQASLEQ-UHFFFAOYSA-N
Synonyms
300375-58-0
(3(4IODOPHENOXY)8METHYL4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)ACETATE
3(4iodophenoxy)8methyl4oxo2(trifluoromethyl)4Hchromen7ylacetate
300375580
CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CC=C(C=C3)I)C(F)(F)F)OC(=O)C
InChI=1SC19H12F3IO5c1914(2610(2)24)871315(25)17(18(19(2021)22)2816(9)13)27125311(23)4612h38H12H3
MFCD00266253
ZINC000001245023
ZINC01245023
ZINC1245023

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.