Vitas-M small molecule compound
3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 2-ethylbutanoate
Catalog ID
STL332440
SMILES CCC(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F)CC
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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 C22H18BrF3O5 MW 499.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrF3O5/c1-3-12(4-2)21(28)29-13-9-10-14-17(11-13)31-20(22(24,25)26)19(18(14)27)30-16-8-6-5-7-15(16)23/h5-12H,3-4H2,1-2H3InChIKey
VQALUNQELVZLFW-UHFFFAOYSA-NSynonyms
315714-13-7(3(2BROMOPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)2ETHYLBUTANOATE
3(2bromophenoxy)4oxo2(trifluoromethyl)4Hchromen7yl2ethylbutanoate
3(2BROMOPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL2ETHYLBUTANOATE
315714137
CCC(CC)C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC=C3Br
InChI=1SC22H18BrF3O5c1312(42)21(28)29139101417(1113)3120(22(2425)26)19(18(14)27)3016865715(16)23h512H34H212H3
MFCD02079696
ZINC000001807426
ZINC01807426
ZINC1807426
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