Skip Navigation Links
ScientificNameLabel
Methyl acetate
PHCD compound ID : 1012
Chemical Names :
Methyl acetate
Molecular Formula : C3H6O2
Molecular Weight : 74.036779
More Details :
Names & Synonyms: methyl acetate , acetic acid methyl ester , methyl ethanoate
Smiles: COC(=O)C
InChi : InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3
InChi Key : InChIKey=KXKVLQRXCPHEJC-UHFFFAOYSA-N
PubChem ID : 6584
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.947932
Hydrogen bond donor count : 0 Electric dipole moment : 1.967
XLogP : 0.241 VDW volume : 75.388407
Molecular weight : 74.036779 HOMO-LUMO gap : 12.014000
Herb list :
Refrences & Litretures:
  
103.      Journal:'International Journal of Food Microbiology'      Year:'2010'      Volume:'139'      Page:'127'      DOI:'10.1016/j.ijfoodmicro.2010.03.032'      Title:'Effect of Matricaria chamomilla L. ?ower essential oil on the growth and ultrastructure of Aspergillus niger van Tieghem'
217.      Journal:'Canadian Journal of Pure and Applied Sciences'      Year:'2013'      Volume:'7'      Page:'2541'      DOI:''      Title:'COMPARISON OF CHEMICAL COMPITION OF ESSENTIAL OIL OF MENTHA LONGIFOLIA L. FROM TWO REGIONS OF IRAN'
227.      Journal:'World J Microbiol Biotechnol'      Year:'2009'      Volume:'25'      Page:'2227'      DOI:'10.1007/s11274-009-0130-3'      Title:'Biological activities of the essential oils and methanol extract of tow cultivated mint species (Mentha longifolia and Mentha pulegium) used in the Tunisian folkloric medicine'
262.      Journal:'J Sci Food Agric'      Year:'1997'      Volume:'74'      Page:'421'      DOI:''      Title:'Strawberry Flavour: Analysis and Biosynthesis'
567.      Journal:'Food Research International'      Year:'2011'      Volume:'44'      Page:'250'      DOI:'10.1016/j.foodres.2010.10.028'      Title:'Dynamics of volatile and non-volatile compounds in cocoa (Theobroma cacao L.) during fermentation and drying processes using principal components analysis'
723.      Journal:'Songklanakarin J. Sci. Technol'      Year:'2014'      Volume:'36'      Page:'83'      DOI:''      Title:'Chemical composition and antimicrobial activity of peppermint (Mentha piperita L.) Essential oil'
839.      Journal:'Russian Chemical Bulletin, International Edition'      Year:'2016'      Volume:'65'      Page:'1148'      DOI:'10.1007/s11172-016-1428-6'      Title:'The volatile constituent analysis of Digitalis nervosa Steud. & Hochst. ex Benth. from Iran'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us