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ScientificNameLabel
Furmecyclox
PHCD compound ID : 3706
Chemical Names :
Furmecyclox
Molecular Formula : C14H21N1O3
Molecular Weight : 251.152144
More Details :
Names & Synonyms: N-cyclohexyl-N-methoxy-2,5-dimethyl-furan-3-carboxamide , N-cyclohexyl-N-methoxy-2,5-dimethyl-3-furancarboxamide , N-cyclohexyl-N-methoxy-2,5-dimethylfuran-3-carboxamide , N-cyclohexyl-N-methoxy-2,5-dimethyl-3-furamide
Smiles: CON(C(=O)c1cc(oc1C)C)C1CCCCC1
InChi : InChI=1S/C14H21NO3/c1-10-9-13(11(2)18-10)14(16)15(17-3)12-7-5-4-6-8-12/h9,12H,4-8H2,1-3H3
InChi Key : InChIKey=QTDRLOKFLJJHTG-UHFFFAOYSA-N
PubChem ID : 43359
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 8.967559
Hydrogen bond donor count : 0 Electric dipole moment : 3.376
XLogP : 2.383 VDW volume : 244.54539
Molecular weight : 251.152144 HOMO-LUMO gap : 9.130000
Herb list :
Refrences & Litretures:
  
513.      Journal:'J. of Supercritical Fluids'      Year:'2014'      Volume:'95'      Page:'373'      DOI:'10.1016/j.sup?u.2014.08.009'      Title:'Bio-oil production from Glycyrrhiza glabra through supercritical ?uid extraction'
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