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ScientificNameLabel
2-Methyl-2-pentenal
PHCD compound ID : 5051
Chemical Names :
2-Methyl-2-pentenal
Molecular Formula : C6H10O1
Molecular Weight : 98.073165
More Details :
Names & Synonyms: (E)-2-methylpent-2-enal , (E)-2-methyl-2-pentenal , (E)-2-methylpent-2-enal
Smiles: C/C(=C\CC)/C=O
InChi : InChI=1S/C6H10O/c1-3-4-6(2)5-7/h4-5H,3H2,1-2H3/b6-4+
InChi Key : InChIKey=IDEYZABHVQLHAF-GQCTYLIASA-N
PubChem ID : 5319754
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 10.071588
Hydrogen bond donor count : 0 Electric dipole moment : 3.358
XLogP : 1.462 VDW volume : 115.849676
Molecular weight : 98.073165 HOMO-LUMO gap : 9.875000
Herb list :
Refrences & Litretures:
  
786.      Journal:'Journal of Food Quality'      Year:'2017'      Volume:''      Page:'6873651'      DOI:'10.1155/2017/6873651'      Title:'Chemical Composition and Antioxidant Properties of Five White Onion (Allium cepa L.) Landraces'
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