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Pentadeca-5,l0-dien-l-o1
ScientificNameLabel
Pentadeca-5,l0-dien-l-o1
PHCD compound ID :
1515
Chemical Names :
Pentadeca-5,l0-dien-l-o1
Molecular Formula :
C15H28O1
Molecular Weight :
224.214016
More Details :
Names & Synonyms:
(5E,10E)-pentadeca-5,10-dien-1-ol , (5E,10E)-1-pentadeca-5,10-dienol
Smiles:
CCCC/C=C/CCC/C=C/CCCCO
InChi :
InChI=1S/C15H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h5-6,10-11,16H,2-4,7-9,12-15H2,1H3/b6-5+,11-10+
InChi Key :
InChIKey=KKBFAANQNYGLKU-RINXSNKBSA-N
PubChem ID :
6536885
Rotatable bond count :
11
Rule of five :
2
Hydrogen bond acceptor count :
1
Ionization potential :
9.511114
Hydrogen bond donor count :
1
Electric dipole moment :
1.670
XLogP :
6.078
VDW volume :
271.513537
Molecular weight :
224.214016
HOMO-LUMO gap :
10.688000
Herb list :
Violet - Viola odorata - بنفشه معطر، بنفشه
Refrences & Litretures:
162. Journal:'Phytochemistry' Year:'1992' Volume:'31' Page:'571' DOI:'' Title:'VOLATILE COMPONENTS OF VIOLET LEAVES'
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