diethyl carbonate

ScientificNameLabel

diethyl carbonate
PHCD compound ID :	2517
Chemical Names :	diethyl carbonate
Molecular Formula :	C5H10O3
Molecular Weight :	118.062994

More Details :

Names & Synonyms:	diethyl carbonate , carbonic acid diethyl ester
Smiles:	CCOC(=O)OCC
InChi :	InChI=1S/C5H10O3/c1-3-7-5(6)8-4-2/h3-4H2,1-2H3
InChi Key :	InChIKey=OIFBSDVPJOWBCH-UHFFFAOYSA-N
PubChem ID :	7766

Rotatable bond count :	4	Rule of five :	0
Hydrogen bond acceptor count :	3	Ionization potential :	11.109544
Hydrogen bond donor count :	0	Electric dipole moment :	0.825
XLogP :	1.258	VDW volume :	118.770603
Molecular weight :	118.062994	HOMO-LUMO gap :	11.691000

Herb list :

Henna - Lawsonia inermis - حنا

Refrences & Litretures:


290. Journal:'Journal of Essential Oil Research' Year:'1995' Volume:'7' Page:'425' DOI:'10.1080/10412905.1995.9698554' Title:'Volatile Components of Lawsonia inermis L. Flowers'

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