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ScientificNameLabel
Benzen ethanol
PHCD compound ID : 5512
Chemical Names :
Benzen ethanol
Molecular Formula : C8H12O1
Molecular Weight : 78.04695
More Details :
Names & Synonyms: benzene;ethanol
Smiles: c1ccccc1.CCO
InChi : InChI=1S/C6H6.C2H6O/c1-2-4-6-5-3-1;1-2-3/h1-6H;3H,2H2,1H3
InChi Key : InChIKey=WVHBHPATSLQXGC-UHFFFAOYSA-N
PubChem ID : 21965192
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 9.896622
Hydrogen bond donor count : 0 Electric dipole moment : 2.087
XLogP : 2.082 VDW volume : 81.166532
Molecular weight : 78.04695 HOMO-LUMO gap : 10.055000
Herb list :
Refrences & Litretures:
  
923.      Journal:'Letters in Applied NanoBioScience'      Year:'2020'      Volume:'9'      Page:'849'      DOI:'10.33263/LIANBS91.849852'      Title:'Chemical composition and antibacterial activity of methanolic extract from Echinops robustus on typical food-borne pathogens'
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