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ScientificNameLabel
12-Methyl tetradecanoic acid
PHCD compound ID : 2563
Chemical Names :
12-Methyl tetradecanoic acid , Tetradecanoic acid,12-methyl
Molecular Formula : C15H30O2
Molecular Weight : 242.22458
More Details :
Names & Synonyms: 12-methyltetradecanoic acid , 12-methylmyristic acid
Smiles: CC[C@H](CCCCCCCCCCC(=O)O)C
InChi : InChI=1S/C15H30O2/c1-3-14(2)12-10-8-6-4-5-7-9-11-13-15(16)17/h14H,3-13H2,1-2H3,(H,16,17)/t14-/m1/s1
InChi Key : InChIKey=XKLJLHAPJBUBNL-CQSZACIVSA-N
PubChem ID : 21672
Rotatable bond count : 12 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 10.831200
Hydrogen bond donor count : 1 Electric dipole moment : 1.979
XLogP : 6.94 VDW volume : 282.940223
Molecular weight : 242.22458 HOMO-LUMO gap : 11.777000
Herb list :
Refrences & Litretures:
  
298.      Journal:'Analytical Chemistry Letters'      Year:'2012'      Volume:'2'      Page:'363'      DOI:'10.1080/22297928.2012.10662621'      Title:'Chemical Composition of Fatty Acid from Different Parts of Descurainia Sophia L. Growing Wild in North of Iran'
554.      Journal:'J Nat Med'      Year:'2015'      Volume:'69'      Page:'387'      DOI:'10.1007/s11418-015-0905-9'      Title:'Alyssum homolocarpum seeds: phytochemical analysis and effects of the seed oil on neural stem cell proliferation and differentiation'
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