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1-lodo-2-methylundecane
ScientificNameLabel
1-lodo-2-methylundecane
PHCD compound ID :
3835
Chemical Names :
1-lodo-2-methylundecane
Molecular Formula :
C12H25I1
Molecular Weight :
296.100099
More Details :
Names & Synonyms:
1-iodo-2-methyl-undecane , 1-iodo-2-methylundecane , 1-iodanyl-2-methyl-undecane
Smiles:
CCCCCCCCC[C@H](CI)C
InChi :
InChI=1S/C12H25I/c1-3-4-5-6-7-8-9-10-12(2)11-13/h12H,3-11H2,1-2H3/t12-/m1/s1
InChi Key :
InChIKey=RTWBFGUVCAVDFO-GFCCVEGCSA-N
PubChem ID :
545590
Rotatable bond count :
9
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
8.915959
Hydrogen bond donor count :
0
Electric dipole moment :
2.694
XLogP :
7.143
VDW volume :
241.385076
Molecular weight :
296.100099
HOMO-LUMO gap :
9.592000
Herb list :
Aloe - Aloe vera - صبر زرد
Refrences & Litretures:
515. Journal:'World J. Agric. Sci' Year:'2009' Volume:'5' Page:'572' DOI:'' Title:'Analysis of Phytochemical Constituents and Antimicrobial Activities of Aloe vera L. Against Clinical Pathogens'
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