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ScientificNameLabel
n-Heptadecanol
PHCD compound ID : 2710
Chemical Names :
n-Heptadecanol , 1-heptadecanol
Molecular Formula : C17H36O1
Molecular Weight : 256.276616
More Details :
Names & Synonyms: heptadecan-1-ol , 1-heptadecanol
Smiles: CCCCCCCCCCCCCCCCCO
InChi : InChI=1S/C17H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h18H,2-17H2,1H3
InChi Key : InChIKey=GOQYKNQRPGWPLP-UHFFFAOYSA-N
PubChem ID : 15076
Rotatable bond count : 15 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.532860
Hydrogen bond donor count : 1 Electric dipole moment : 1.837
XLogP : 8.248 VDW volume : 311.378424
Molecular weight : 256.276616 HOMO-LUMO gap : 13.379000
Herb list :
Refrences & Litretures:
  
314.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2012'      Volume:'15'      Page:'373'      DOI:'10.1080/0972060X.2012.10644063'      Title:'Chemical Composition and Antimicrobial Activity of the Essential Oil of Verbascum thapsus L'
368.      Journal:'Journal of Reports in Pharmaceutical Sciences'      Year:'2013'      Volume:'2'      Page:'165'      DOI:''      Title:'Chemical Composition and General Toxicity of Essential Oil Extracted from the Stalks and Flowers of Rheum Ribes L. Growing in Iran'
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