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ScientificNameLabel
2-Methylpentadecane
PHCD compound ID : 242
Chemical Names :
2-Methylpentadecane
Molecular Formula : C16H34
Molecular Weight : 226.266051
More Details :
Names & Synonyms: 2-methylpentadecane
Smiles: CCCCCCCCCCCCCC(C)C
InChi : InChI=1S/C16H34/c1-4-5-6-7-8-9-10-11-12-13-14-15-16(2)3/h16H,4-15H2,1-3H3
InChi Key : InChIKey=BANXPJUEBPWEOT-UHFFFAOYSA-N
PubChem ID : 15267
Rotatable bond count : 12 Rule of five : 2
Hydrogen bond acceptor count : 0 Ionization potential : 10.677489
Hydrogen bond donor count : 0 Electric dipole moment : 0.029
XLogP : 9.383 VDW volume : 285.292213
Molecular weight : 226.266051 HOMO-LUMO gap : 14.496000
Herb list :
Refrences & Litretures:
  
14.      Journal:'Phytochem. Anal. 2014, 25, 273'      Year:'2014'      Volume:'25'      Page:'273'      DOI:'10.1002/pca.2503'      Title:'Chemometric Resolution Approaches in Characterisation of Volatile Constituents in Plantago ovata Seeds using Gas Chromatography–Mass Spectrometry: Methodology and Performance Assessment'
542.      Journal:'Folia Pomer. Univ. Technol. Stetin., Agric., Aliment., Pisc., Zootech'      Year:'2015'      Volume:'320'      Page:'95'      DOI:''      Title:'GC-MS ANALYSIS OF ESSENTIAL OILS ISOLATED FROM FRUITS OF CHOSEN HOT PEPPER (CAPSICUM ANNUUM L.) CULTIVARS'
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