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10-Nonadecenoic acid
ScientificNameLabel
10-Nonadecenoic acid
PHCD compound ID :
2527
Chemical Names :
10-Nonadecenoic acid
Molecular Formula :
C19H36O2
Molecular Weight :
296.27153
More Details :
Names & Synonyms:
nonadec-10-enoic acid , 10-nonadecenoic acid
Smiles:
CCCCCCCC/C=C/CCCCCCCCC(=O)O
InChi :
InChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h9-10H,2-8,11-18H2,1H3,(H,20,21)/b10-9+
InChi Key :
InChIKey=BBOWBNGUEWHNQZ-MDZDMXLPSA-N
PubChem ID :
250154
Rotatable bond count :
16
Rule of five :
2
Hydrogen bond acceptor count :
2
Ionization potential :
9.579251
Hydrogen bond donor count :
1
Electric dipole moment :
1.873
XLogP :
8.761
VDW volume :
349.487703
Molecular weight :
296.27153
HOMO-LUMO gap :
10.557000
Herb list :
Milk thistle, St. Mary thistle, Holy thistle - Silybum marianum - خار مریم
Refrences & Litretures:
291. Journal:'Food and Bioproducts Processing' Year:'2012' Volume:'90' Page:'87' DOI:'10.1016/j.fbp.2011.02.010' Title:'Optimization of enzymatic pretreatment for n-hexane extraction of oil from Silybum marianum seeds using response surface methodology'
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