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ScientificNameLabel
Ethyl formate
PHCD compound ID : 2264
Chemical Names :
Ethyl formate
Molecular Formula : C3H6O2
Molecular Weight : 74.036779
More Details :
Names & Synonyms: ethyl formate , formic acid ethyl ester , ethyl methanoate
Smiles: CCOC=O
InChi : InChI=1S/C3H6O2/c1-2-5-3-4/h3H,2H2,1H3
InChi Key : InChIKey=WBJINCZRORDGAQ-UHFFFAOYSA-N
PubChem ID : 8025
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 11.043668
Hydrogen bond donor count : 0 Electric dipole moment : 2.046
XLogP : 0.428 VDW volume : 75.388407
Molecular weight : 74.036779 HOMO-LUMO gap : 11.933000
Herb list :
Refrences & Litretures:
  
262.      Journal:'J Sci Food Agric'      Year:'1997'      Volume:'74'      Page:'421'      DOI:''      Title:'Strawberry Flavour: Analysis and Biosynthesis'
749.      Journal:'J. Agric. food Chem'      Year:'1983'      Volume:'31'      Page:'38'      DOI:'10.1021/jf00115a010'      Title:'Composition of the Essential Oil of Alfalfa'
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