1,1-Dihexoxyethane

ScientificNameLabel

1,1-Dihexoxyethane
PHCD compound ID :	2353
Chemical Names :	1,1-Dihexoxyethane
Molecular Formula :	C14H30O2
Molecular Weight :	230.22458

More Details :

Names & Synonyms:	1-(1-hexoxyethoxy)hexane
Smiles:	CCCCCCOC(OCCCCCC)C
InChi :	InChI=1S/C14H30O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h14H,4-13H2,1-3H3
InChi Key :	InChIKey=VSFOOCQEJQKBSO-UHFFFAOYSA-N
PubChem ID :	21503

Rotatable bond count :	12	Rule of five :	2
Hydrogen bond acceptor count :	2	Ionization potential :	9.967295
Hydrogen bond donor count :	0	Electric dipole moment :	2.237
XLogP :	5.403	VDW volume :	268.280697
Molecular weight :	230.22458	HOMO-LUMO gap :	12.258000

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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