Vitas-M small molecule compound
methyl 3-methyl-4-oxo-6-[4-(propan-2-yl)phenyl]-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylate
Catalog ID
STL531901
SMILES COC(=O)c1oc2c(c1C)C(=O)CC(C2)c1ccc(cc1)C(C)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 C20H22O4 MW 326.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22O4/c1-11(2)13-5-7-14(8-6-13)15-9-16(21)18-12(3)19(20(22)23-4)24-17(18)10-15/h5-8,11,15H,9-10H2,1-4H3InChIKey
CBCNWSQQAZIOEP-UHFFFAOYSA-NSynonyms
864752-55-64964896
864752556
InChI=1SC20H22O4c111(2)135714(8613)15916(21)1812(3)19(20(22)234)2417(18)1015h581115H910H214H3
methyl3methyl4oxo6(4(propan2yl)phenyl)4567tetrahydro1benzofuran2carboxylate
methyl3methyl4oxo6(4propan2ylphenyl)67dihydro5~(H)1benzofuran2carboxylate
METHYL3METHYL4OXO6(4PROPAN2YLPHENYL)67DIHYDRO5H1BENZOFURAN2CARBOXYLATE
methyl6(4isopropylphenyl)3methyl4oxo4567tetrahydrobenzofuran2carboxylate
MFCD06767121
ZINC000004085336
ZINC000004085337
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