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ScientificNameLabel
Phenol,nonyl
PHCD compound ID : 4580
Chemical Names :
Phenol,nonyl
Molecular Formula : C15H24O1
Molecular Weight : 220.182715
More Details :
Names & Synonyms: 2-nonylphenol
Smiles: CCCCCCCCCc1ccccc1O
InChi : InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16/h9-10,12-13,16H,2-8,11H2,1H3
InChi Key : InChIKey=SNQQPOLDUKLAAF-UHFFFAOYSA-N
PubChem ID : 67296
Rotatable bond count : 8 Rule of five : 1
Hydrogen bond acceptor count : 1 Ionization potential : 9.016524
Hydrogen bond donor count : 1 Electric dipole moment : 0.809
XLogP : 5.574 VDW volume : 245.62062
Molecular weight : 220.182715 HOMO-LUMO gap : 9.154000
Herb list :
Refrences & Litretures:
  
703.      Journal:'BioMed Research International'      Year:'2013'      Volume:'2013'      Page:'1'      DOI:'10.1155/2013/696835'      Title:'Chemical Composition and Antibacterial and Cytotoxic Activities of Allium hirtifolium Boiss'
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