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ScientificNameLabel
1-Butoxy-1-ethoxyethane
PHCD compound ID : 2349
Chemical Names :
1-Butoxy-1-ethoxyethane
Molecular Formula : C8H18O2
Molecular Weight : 146.13068
More Details :
Names & Synonyms: 1-(1-ethoxyethoxy)butane
Smiles: CCCCO[C@@H](OCC)C
InChi : InChI=1S/C8H18O2/c1-4-6-7-10-8(3)9-5-2/h8H,4-7H2,1-3H3/t8-/m1/s1
InChi Key : InChIKey=VULXTAWRXFGMKL-MRVPVSSYSA-N
PubChem ID : 552119
Rotatable bond count : 6 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.918380
Hydrogen bond donor count : 0 Electric dipole moment : 2.206
XLogP : 2.2 VDW volume : 164.504789
Molecular weight : 146.13068 HOMO-LUMO gap : 12.243000
Herb list :
Refrences & Litretures:
  
262.      Journal:'J Sci Food Agric'      Year:'1997'      Volume:'74'      Page:'421'      DOI:''      Title:'Strawberry Flavour: Analysis and Biosynthesis'
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