3-Ethoxyacrylonitrile

ScientificNameLabel

3-Ethoxyacrylonitrile
PHCD compound ID :	4770
Chemical Names :	3-Ethoxyacrylonitrile
Molecular Formula :	C5H7N1O1
Molecular Weight :	97.052764

More Details :

Names & Synonyms:	(E)-3-ethoxyprop-2-enenitrile , (E)-3-ethoxy-2-propenenitrile , (E)-3-ethoxyacrylonitrile
Smiles:	CCO/C=C/C#N
InChi :	InChI=1S/C5H7NO/c1-2-7-5-3-4-6/h3,5H,2H2,1H3/b5-3+
InChi Key :	InChIKey=HUPVIAINOSTNBJ-HWKANZROSA-N
PubChem ID :	5324714

Rotatable bond count :	2	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	9.862168
Hydrogen bond donor count :	0	Electric dipole moment :	6.096
XLogP :	0.727	VDW volume :	106.913993
Molecular weight :	97.052764	HOMO-LUMO gap :	9.695000

Herb list :

True lavender - Lavandula officinalis - اسطوخودوس

Refrences & Litretures:


760. Journal:'International Journal of ChemTech Research' Year:'2014' Volume:'6' Page:'4918' DOI:'' Title:'Chemical composition and fungitoxic activities of Lavandula officinalis L. oil and comparison with synthetic fungicide on the growth some fungi in vitro'

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