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ScientificNameLabel
n-Tridecanoic
PHCD compound ID : 1555
Chemical Names :
Tridecanoic acid , n-Tridecanoic
Molecular Formula : C13H26O2
Molecular Weight : 214.19328
More Details :
Names & Synonyms: tridecanoic acid
Smiles: CCCCCCCCCCCCC(=O)O
InChi : InChI=1S/C13H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3,(H,14,15)
InChi Key : InChIKey=SZHOJFHSIKHZHA-UHFFFAOYSA-N
PubChem ID : 12530
Rotatable bond count : 11 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 10.962565
Hydrogen bond donor count : 1 Electric dipole moment : 1.904
XLogP : 5.863 VDW volume : 248.348254
Molecular weight : 214.19328 HOMO-LUMO gap : 11.907000
Herb list :
Refrences & Litretures:
  
171.      Journal:'Med Aromat Plants'      Year:'2012'      Volume:'1'      Page:'1000e134'      DOI:'10.4172/2167-0412.1000e134'      Title:'Chemical Composition of the Essential Oil of Quince (Cydonia Oblonga Miller) Leaves'
249.      Journal:'Pak. J. Bot'      Year:'2008'      Volume:'40'      Page:'2553'      DOI:''      Title:'CHEMICAL CONSTITUENTS OF TAMARINDUS INDICA L. MEDICINAL PLANT IN SINDH'
262.      Journal:'J Sci Food Agric'      Year:'1997'      Volume:'74'      Page:'421'      DOI:''      Title:'Strawberry Flavour: Analysis and Biosynthesis'
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'
459.      Journal:'Flavour Fragr. J'      Year:'2007'      Volume:'22'      Page:'148'      DOI:'10.1002/ffj.1773'      Title:'Chemical composition of seed essential oils from Algerian Nigella sativa extracted by microwave and hydrodistillation'
622.      Journal:'J. Essent. Oil Res'      Year:'2006'      Volume:'18'      Page:'189'      DOI:'10.1080/10412905.2006.9699063'      Title:'Yield, Essential Oil Content and Composition of Coriandrum sativum Varieties (var. vulgare Alef and var. microcarpum DC.) Grown in Two Different Locations'
773.      Journal:'CHEMISTRY & BIODIVERSITY'      Year:'2012'      Volume:'9'      Page:'359'      DOI:'10.1002/cbdv.201100326'      Title:'Determination of the Volatile Fraction of Polygonum bistorta L. at Different Growing Stages and Evaluation of Its Antimicrobial Activity against Two Major Honeybee (Apis mellifera) Pathogens'
888.      Journal:'FLAVOUR AND FRAGRANCE JOURNAL'      Year:'1996'      Volume:'11'      Page:'57'      DOI:'10.1002/(SICI)1099-1026(199601)11:1<57::AID-FFJ549>3.0.CO;2-K'      Title:'Volatile Components of the Rhizomes of Rheum palmatum L'
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