3-ethoxy-1-propanol

ScientificNameLabel

3-ethoxy-1-propanol
PHCD compound ID :	663
Chemical Names :	3-ethoxy-1-propanol
Molecular Formula :	C5H12O2
Molecular Weight :	104.08373

More Details :

Names & Synonyms:	3-ethoxypropan-1-ol , 3-ethoxy-1-propanol
Smiles:	OCCCOCC
InChi :	InChI=1S/C5H12O2/c1-2-7-5-3-4-6/h6H,2-5H2,1H3
InChi Key :	InChIKey=XHMWPVBQGARKQM-UHFFFAOYSA-N
PubChem ID :	8109

Rotatable bond count :	4	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	9.864415
Hydrogen bond donor count :	1	Electric dipole moment :	3.099
XLogP :	0.092	VDW volume :	112.616835
Molecular weight :	104.08373	HOMO-LUMO gap :	12.191000

Herb list :

Grape, Vine grape - Vitis vinifera - انگور

Refrences & Litretures:


40. Journal:'J. Agric. Food Chem' Year:'2003' Volume:'51' Page:'5408' DOI:'10.1021/jf030087i' Title:'Aroma Composition of Vitis vinifera Cv. Tannat: the Typical Red Wine from Uruguay'

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