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Compound: 5546
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References: 992
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(E)-5-Tetradecen-3-yne
ScientificNameLabel
(E)-5-Tetradecen-3-yne
PHCD compound ID :
1319
Chemical Names :
(E)-5-Tetradecen-3-yne
Molecular Formula :
C14H24
Molecular Weight :
192.187801
More Details :
Names & Synonyms:
(E)-tetradec-5-en-3-yne
Smiles:
CCCCCCCC/C=C/C#CCC
InChi :
InChI=1S/C14H24/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h10,12H,3-5,7,9,11,13-14H2,1-2H3/b12-10+
InChi Key :
InChIKey=SAENIUAOMAUCLN-ZRDIBKRKSA-N
PubChem ID :
5367321
Rotatable bond count :
7
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
9.138234
Hydrogen bond donor count :
0
Electric dipole moment :
0.480
XLogP :
6.982
VDW volume :
242.790867
Molecular weight :
192.187801
HOMO-LUMO gap :
9.581000
Herb list :
Bay - Laurus nobilis - برگ بو
Refrences & Litretures:
141. Journal:'J Sci Food Agric' Year:'2014' Volume:'94' Page:'1197' DOI:'10.1002/jsfa.6397' Title:'Chemical composition and antioxidant properties of Laurus nobilis L. and Myrtus communis L. essential oils from Morocco and evaluation of their antimicrobial activity acting alone or in combined processes for food preservation'
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