Skip Navigation Links
ScientificNameLabel
6,4,10-trimethyl-2-Pentadecanone
PHCD compound ID : 4084
Chemical Names :
6,4,10-trimethyl-2-Pentadecanone
Molecular Formula : C18H36O1
Molecular Weight : 268.276616
More Details :
Names & Synonyms:
Smiles: CCCCC[C@H](CCC[C@@H](C[C@H](CC(=O)C)C)C)C
InChi : InChI=1S/C18H36O/c1-6-7-8-10-15(2)11-9-12-16(3)13-17(4)14-18(5)19/h15-17H,6-14H2,1-5H3/t15-,16+,17-/m1/s1
InChi Key : InChIKey=PEBYJSJUHILWJV-IXDOHACOSA-N
PubChem ID :
Rotatable bond count : 12 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.029610
Hydrogen bond donor count : 0 Electric dipole moment : 3.063
XLogP : 8.221 VDW volume : 326.03795
Molecular weight : 268.276616 HOMO-LUMO gap : 11.017000
Herb list :
Refrences & Litretures:
  
561.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2011'      Volume:'14'      Page:'472'      DOI:'10.1080/0972060X.2011.10643603'      Title:'Composition of the Essential Oils of Anthemis Hyalina DC., Achillea Nobilis L. and Cichorium intybus L. Three Asteraceae Herbs Growing Wild in Iran'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us