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Compound: 5546
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References: 992
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14-Methyl-8-hexadecyn-1-ol
ScientificNameLabel
14-Methyl-8-hexadecyn-1-ol
PHCD compound ID :
5731
Chemical Names :
14-Methyl-8-hexadecyn-1-ol
Molecular Formula :
C17H32O1
Molecular Weight :
252.245316
More Details :
Names & Synonyms:
14-methylhexadec-8-yn-1-ol , 14-methyl-8-hexadecyn-1-ol
Smiles:
OCCCCCCCC#CCCCC[C@@H](CC)C
InChi :
InChI=1S/C17H32O/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18/h17-18H,3-4,6,8-16H2,1-2H3/t17-/m1/s1
InChi Key :
InChIKey=GGNPJEDYBWMUJF-QGZVFWFLSA-N
PubChem ID :
556973
Rotatable bond count :
11
Rule of five :
2
Hydrogen bond acceptor count :
1
Ionization potential :
9.912235
Hydrogen bond donor count :
1
Electric dipole moment :
1.687
XLogP :
6.977
VDW volume :
306.105507
Molecular weight :
252.245316
HOMO-LUMO gap :
11.708000
Herb list :
Golden rod, Wound-weed - Solidago virgaurea - علف طلائی
Refrences & Litretures:
974. Journal:'European Food Research and Technology' Year:'2018' Volume:'244' Page:'1169' DOI:'10.1007/s00217-018-3034-3' Title:'Chromatographic fingerprint, antioxidant activity, and colour characteristic of polish goldenrod (Solidago virgaurea L.) honey and lower'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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