2-(1-Pentenyl)furan

ScientificNameLabel

2-(1-Pentenyl)furan
PHCD compound ID :	4284
Chemical Names :	2-(1-Pentenyl)furan
Molecular Formula :	C9H12O1
Molecular Weight :	136.088815

More Details :

Names & Synonyms:	2-[(E)-pent-1-enyl]furan
Smiles:	CCC/C=C/c1ccco1
InChi :	InChI=1S/C9H12O/c1-2-3-4-6-9-7-5-8-10-9/h4-8H,2-3H2,1H3/b6-4+
InChi Key :	InChIKey=LKSYSJTUBQSZBS-GQCTYLIASA-N
PubChem ID :	5369956

Rotatable bond count :	3	Rule of five :	0
Hydrogen bond acceptor count :	1	Ionization potential :	8.727831
Hydrogen bond donor count :	0	Electric dipole moment :	1.207
XLogP :	2.794	VDW volume :	141.844712
Molecular weight :	136.088815	HOMO-LUMO gap :	8.655000

Herb list :

Nettle, Stinging nettle - Urtica dioica - گزنه دو پایه، گزنه

Refrences & Litretures:


618. Journal:'Chemistry of Natural Compounds' Year:'2012' Volume:'48' Page:'506' DOI:'' Title:'CHEMICAL COMPOSITION OF THE ESSENTIAL OIL OF Urtica dioica'

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