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ScientificNameLabel
2-phenoxyethyl 3-hydroxy benzoate
PHCD compound ID : 533
Chemical Names :
2-phenoxyethyl 3-hydroxy benzoate
Molecular Formula : C15H14O4
Molecular Weight : 258.089209
More Details :
Names & Synonyms: 2-phenoxyethyl 3-hydroxybenzoate , 3-hydroxybenzoic acid 2-phenoxyethyl ester , 2-phenoxyethyl 3-oxidanylbenzoate
Smiles: Oc1cccc(c1)C(=O)OCCOc1ccccc1
InChi : InChI=1S/C15H14O4/c16-13-6-4-5-12(11-13)15(17)19-10-9-18-14-7-2-1-3-8-14/h1-8,11,16H,9-10H2
InChi Key : InChIKey=YPFCOSYRIJPJNT-UHFFFAOYSA-N
PubChem ID : 13505356
Rotatable bond count : 6 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 9.070154
Hydrogen bond donor count : 1 Electric dipole moment : 3.672
XLogP : 1.646 VDW volume : 238.189007
Molecular weight : 258.089209 HOMO-LUMO gap : 8.339000
Herb list :
Refrences & Litretures:
  
32.      Journal:'Iranian Journal of Pharmaceutical Research'      Year:'2014'      Volume:'13'      Page:'1173'      DOI:''      Title:'Synthesis and Biological Evaluation of Novel Mono Acid Esters Derived from the Constituents of Urtica pilulifera'
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