Acetic acid anhydride

ScientificNameLabel

Acetic acid anhydride
PHCD compound ID :	4568
Chemical Names :	Acetic acid anhydride
Molecular Formula :	C4H6O3
Molecular Weight :	102.031694

More Details :

Names & Synonyms:	acetyl acetate , acetic acid acetyl ester , ethanoyl ethanoate
Smiles:	CC(=O)OC(=O)C
InChi :	InChI=1S/C4H6O3/c1-3(5)7-4(2)6/h1-2H3
InChi Key :	InChIKey=WFDIJRYMOXRFFG-UHFFFAOYSA-N
PubChem ID :	7918

Rotatable bond count :	2	Rule of five :	0
Hydrogen bond acceptor count :	3	Ionization potential :	10.731608
Hydrogen bond donor count :	0	Electric dipole moment :	4.853
XLogP :	0.691	VDW volume :	98.83816
Molecular weight :	102.031694	HOMO-LUMO gap :	11.266000

Herb list :

Wild garlic - Allium hirtifolium - موسیر

Refrences & Litretures:


703. Journal:'BioMed Research International' Year:'2013' Volume:'2013' Page:'1' DOI:'10.1155/2013/696835' Title:'Chemical Composition and Antibacterial and Cytotoxic Activities of Allium hirtifolium Boiss'

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