Vitas-M small molecule compound
(3E)-3-(furan-2-ylmethylidene)-5-(2-methylpropyl)furan-2(3H)-one
Catalog ID
STL513247
SMILES CC(CC1=C/C(=C\c2ccco2)/C(=O)O1)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 C13H14O3 MW 218.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14O3/c1-9(2)6-12-8-10(13(14)16-12)7-11-4-3-5-15-11/h3-5,7-9H,6H2,1-2H3/b10-7+InChIKey
GQAQMODYIXRCPZ-JXMROGBWSA-NSynonyms
374763-61-8(3~(E))3(furan2ylmethylidene)5(2methylpropyl)furan2one
(3E)3(furan2ylmethylidene)5(2methylpropyl)furan2(3H)one
(3E)3(FURAN2YLMETHYLIDENE)5(2METHYLPROPYL)FURAN2ONE
(E)3(furan2ylmethylene)5isobutylfuran2(3H)one
1765192
374763618
CC(CC1=CC(=Cc2ccco2)C(=O)O1)C
InChI=1SC13H14O3c19(2)612810(13(14)1612)7114351511h3579H6H212H3b107+
MFCD02059582
ZINC000005632805
ZINC5632805
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