1,1-Diethoxypentane

ScientificNameLabel

1,1-Diethoxypentane
PHCD compound ID :	2354
Chemical Names :	1,1-Diethoxypentane
Molecular Formula :	C9H20O2
Molecular Weight :	160.14633

More Details :

Names & Synonyms:	1,1-diethoxypentane
Smiles:	CCCCC(OCC)OCC
InChi :	InChI=1S/C9H20O2/c1-4-7-8-9(10-5-2)11-6-3/h9H,4-8H2,1-3H3
InChi Key :	InChIKey=XCWKYQWOLSOBCC-UHFFFAOYSA-N
PubChem ID :	77223

Rotatable bond count :	7	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	9.735543
Hydrogen bond donor count :	0	Electric dipole moment :	2.031
XLogP :	2.769	VDW volume :	181.800774
Molecular weight :	160.14633	HOMO-LUMO gap :	12.028000

Herb list :

Strawberry - Fragaria vesca - توت فرنگی

Refrences & Litretures:


262. Journal:'J Sci Food Agric' Year:'1997' Volume:'74' Page:'421' DOI:'' Title:'Strawberry Flavour: Analysis and Biosynthesis'

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