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ScientificNameLabel
o-Cresol
PHCD compound ID : 70
Chemical Names :
2-Methyl-phenol , 2-methyl-5-phenol , o-Cresol
Molecular Formula : C7H8O1
Molecular Weight : 108.057515
More Details :
Names & Synonyms: o-cresol , 2-methylphenol
Smiles: Cc1ccccc1O
InChi : InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3
InChi Key : InChIKey=QWVGKYWNOKOFNN-UHFFFAOYSA-N
PubChem ID : 335
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.003692
Hydrogen bond donor count : 1 Electric dipole moment : 0.745
XLogP : 1.127 VDW volume : 107.252743
Molecular weight : 108.057515 HOMO-LUMO gap : 9.159000
Herb list :
Refrences & Litretures:
  
4.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2013'      Volume:'16'      Page:'850'      DOI:'10.1080/0972060X.2013.861993'      Title:'Chemical Composition of Peganum harmala Smoke and Volatile Oil'
622.      Journal:'J. Essent. Oil Res'      Year:'2006'      Volume:'18'      Page:'189'      DOI:'10.1080/10412905.2006.9699063'      Title:'Yield, Essential Oil Content and Composition of Coriandrum sativum Varieties (var. vulgare Alef and var. microcarpum DC.) Grown in Two Different Locations'
772.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2012'      Volume:'15'      Page:'964'      DOI:'10.1080/0972060X.2012.10662600'      Title:'Difference in Essential Oil Composition of Rhizome of Polygonum bistorta L. from Different Asian Regions and Evaluation of its Antibacterial Activity'
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