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ScientificNameLabel
Ethyl para-ethoxybenzoate
PHCD compound ID : 3908
Chemical Names :
Ethyl para-ethoxybenzoate , Benzoic acid,4-ethoxy-,ethyl ester
Molecular Formula : C11H14O3
Molecular Weight : 194.094294
More Details :
Names & Synonyms: ethyl 4-ethoxybenzoate , 4-ethoxybenzoic acid ethyl ester
Smiles: CCOc1ccc(cc1)C(=O)OCC
InChi : InChI=1S/C11H14O3/c1-3-13-10-7-5-9(6-8-10)11(12)14-4-2/h5-8H,3-4H2,1-2H3
InChi Key : InChIKey=HRAQMGWTPNOILP-UHFFFAOYSA-N
PubChem ID : 90232
Rotatable bond count : 5 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.281975
Hydrogen bond donor count : 0 Electric dipole moment : 4.217
XLogP : 1.756 VDW volume : 191.380676
Molecular weight : 194.094294 HOMO-LUMO gap : 8.962000
Herb list :
Refrences & Litretures:
  
532.      Journal:'J PURE APPL MICROBIO'      Year:'2013'      Volume:'7'      Page:'379'      DOI:''      Title:'Chemical Composition and Antimicrobial Activity of Ziziphus jujuba Seeds Extract'
656.      Journal:'Int. J. LifeSc. Bt & Pharm. Res'      Year:'2012'      Volume:'1'      Page:'164'      DOI:''      Title:'ANTIBACTERIAL ACTIVITY OF PUNICA GRANATUM PEEL EXTRACTS AGAINST SHIGA TOXIN PRODUCING E. COLI'
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