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ScientificNameLabel
5-Methyl-5-ethenyldihydro-2(3H)-furanone
PHCD compound ID : 939
Chemical Names :
5-Methyl-5-ethenyldihydro-2(3H)-furanone
Molecular Formula : C8H14O1
Molecular Weight : 126.104465
More Details :
Names & Synonyms: 2,5-dimethyl-2-vinyl-tetrahydrofuran , 2-ethenyl-2,5-dimethyloxolane , 2-ethenyl-2,5-dimethyl-oxolane
Smiles: C[C@@]1(CC[C@@H](O1)C)C=C
InChi : InChI=1S/C8H14O/c1-4-8(3)6-5-7(2)9-8/h4,7H,1,5-6H2,2-3H3/t7-,8-/m0/s1
InChi Key : InChIKey=UZNFMVFUQYWYET-YUMQZZPRSA-N
PubChem ID : 12735920
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.630885
Hydrogen bond donor count : 0 Electric dipole moment : 1.791
XLogP : 1.814 VDW volume : 140.721645
Molecular weight : 126.104465 HOMO-LUMO gap : 10.828000
Herb list :
Refrences & Litretures:
  
74.      Journal:'Food Chemistry'      Year:'1998'      Volume:'63'      Page:'373'      DOI:''      Title:'Study of the composition of the different parts of a Spanish Thymes vulgaris L. plant'
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