Vitas-M small molecule compound

3-methylbutyl {[3-(3-methylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}acetate

Catalog ID
STL332302
SMILES CC(CCOC(=O)COc1ccc2c(c1)oc(c(c2=O)Oc1cccc(c1)C)C(F)(F)F)C

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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 C24H23F3O6 MW 464.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23F3O6/c1-14(2)9-10-30-20(28)13-31-16-7-8-18-19(12-16)33-23(24(25,26)27)22(21(18)29)32-17-6-4-5-15(3)11-17/h4-8,11-12,14H,9-10,13H2,1-3H3
InChIKey
LZNJOFDESAWNQH-UHFFFAOYSA-N
Synonyms
347366-23-8
347366238
3methylbutyl((3(3methylphenoxy)4oxo2(trifluoromethyl)4Hchromen7yl)oxy)acetate
3METHYLBUTYL2(3(3METHYLPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)OXYACETATE
3METHYLBUTYL2(3(3METHYLPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YLOXY)ACETATE
CC1=CC(=CC=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)OCCC(C)C)C(F)(F)F
InChI=1SC24H23F3O6c114(2)9103020(28)133116781819(1216)3323(24(2526)27)22(21(18)29)321764515(3)1117h48111214H91013H213H3
isopentyl2((4oxo3(mtolyloxy)2(trifluoromethyl)4Hchromen7yl)oxy)acetate
MFCD02333651
ZINC000001770047
ZINC01770047
ZINC1770047

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Available files

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