Vitas-M small molecule compound
2-[(2E)-3-(furan-2-yl)prop-2-enoyl]-5,5-dimethylcyclohexane-1,3-dione
Catalog ID
STL512996
SMILES O=C1CC(C)(C)CC(=O)C1C(=O)/C=C/c1ccco1
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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 C15H16O4 MW 260.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16O4/c1-15(2)8-12(17)14(13(18)9-15)11(16)6-5-10-4-3-7-19-10/h3-7,14H,8-9H2,1-2H3/b6-5+InChIKey
HAMRLFXHVTXOIB-AATRIKPKSA-NSynonyms
331965-84-5(E)2(3(FURAN2YL)ACRYLOYL)55DIMETHYLCYCLOHEXANE13DIONE
2((~(E))3(furan2yl)prop2enoyl)55dimethylcyclohexane13dione
2((2E)3(2FURYL)PROP2ENOYL)55DIMETHYLCYCLOHEXANE13DIONE
2((2E)3(furan2yl)prop2enoyl)55dimethylcyclohexane13dione
2((E)3(FURAN2YL)PROP2ENOYL)55DIMETHYLCYCLOHEXANE13DIONE
2(3FURAN2YLACRYLOYL)55DIMETHYLCYCLOHEXANE13DIONE
331965845
788344
InChI=1SC15H16O4c115(2)812(17)14(13(18)915)11(16)65104371910h3714H89H212H3b65+
MFCD00475497
O=C1CC(C)(C)CC(=O)C1C(=O)C=Cc1ccco1
ZINC000100551775
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