Vitas-M small molecule compound

methyl 2-methyl-5-[(pentafluorobenzyl)oxy]-1-benzofuran-3-carboxylate

Catalog ID
STK837636
SMILES COC(=O)c1c(C)oc2c1cc(OCc1c(F)c(F)c(c(c1F)F)F)cc2

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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 C18H11F5O4 MW 386.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11F5O4/c1-7-12(18(24)25-2)9-5-8(3-4-11(9)27-7)26-6-10-13(19)15(21)17(23)16(22)14(10)20/h3-5H,6H2,1-2H3
InChIKey
FMUGTHCIEJIJOV-UHFFFAOYSA-N
Synonyms
300557-13-5
300557135
CC1=C(C2=C(O1)C=CC(=C2)OCC3=C(C(=C(C(=C3F)F)F)F)F)C(=O)OC
InChI=1SC18H11F5O4c1712(18(24)252)958(3411(9)277)2661013(19)15(21)17(23)16(22)14(10)20h35H6H212H3
methyl2methyl5((23456pentafluorophenyl)methoxy)1benzofuran3carboxylate
methyl2methyl5((pentafluorobenzyl)oxy)1benzofuran3carboxylate
METHYL2METHYL5((PERFLUOROPHENYL)METHOXY)BENZOFURAN3CARBOXYLATE
MFCD01847196
ZINC000002289379
ZINC02289379
ZINC2289379

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Available files

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