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ScientificNameLabel
4-Hydroxy-3-methoxy phenyl formate
PHCD compound ID : 1888
Chemical Names :
4-Hydroxy-3-methoxy phenyl formate
Molecular Formula : C8H8O4
Molecular Weight : 168.042259
More Details :
Names & Synonyms: (4-hydroxy-3-methoxy-phenyl) formate , formic acid (4-hydroxy-3-methoxyphenyl) ester , (4-hydroxy-3-methoxyphenyl) formate , (3-methoxy-4-oxidanyl-phenyl) methanoate , formic acid (4-hydroxy-3-methoxy-phenyl) ester
Smiles: O=COc1ccc(c(c1)OC)O
InChi : InChI=1S/C8H8O4/c1-11-8-4-6(12-5-9)2-3-7(8)10/h2-5,10H,1H3
InChi Key : InChIKey=NFFCPYMNLCXMQA-UHFFFAOYSA-N
PubChem ID : 11147942
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 8.677459
Hydrogen bond donor count : 1 Electric dipole moment : 2.539
XLogP : 0.849 VDW volume : 148.282949
Molecular weight : 168.042259 HOMO-LUMO gap : 8.576000
Herb list :
Refrences & Litretures:
  
223.      Journal:'J. Med. Plants Res'      Year:'2013'      Volume:'7'      Page:'3003'      DOI:'10.5897/JMPR12.1270'      Title:'Chemical composition of the essential oil of Mentha pulegium L. from Taftan Area by means of gas chromatography/mass spectrometry (GC/MS)'
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