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ScientificNameLabel
Dotriacontane
PHCD compound ID : 935
Chemical Names :
Dotriacontane , Ethyl triacontane , Methyl hentriacontane
Molecular Formula : C32H66
Molecular Weight : 450.516452
More Details :
Names & Synonyms: dotriacontane
Smiles: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
InChi : InChI=1S/C32H66/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
InChi Key : InChIKey=QHMGJGNTMQDRQA-UHFFFAOYSA-N
PubChem ID : 11008
Rotatable bond count : 29 Rule of five : 2
Hydrogen bond acceptor count : 0 Ionization potential : 10.562155
Hydrogen bond donor count : 0 Electric dipole moment : 0.084
XLogP : 18.548 VDW volume : 562.027967
Molecular weight : 450.516452 HOMO-LUMO gap : 14.499000
Herb list :
Refrences & Litretures:
  
74.      Journal:'Food Chemistry'      Year:'1998'      Volume:'63'      Page:'373'      DOI:''      Title:'Study of the composition of the different parts of a Spanish Thymes vulgaris L. plant'
312.      Journal:'Talanta'      Year:'2010'      Volume:'81'      Page:'129'      DOI:'10.1016/j.talanta.2009.11.047'      Title:'Identi?cation of Portulaca oleracea L. from different sources using GC–MS and FT-IR spectroscopy'
678.      Journal:'Molecules'      Year:'2013'      Volume:'18'      Page:'14948'      DOI:'10.3390/molecules181214948'      Title:'Chemical Composition and Biological Activity of Essential Oils of Origanum vulgare L. subsp. vulgare L. under Different Growth Conditions'
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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