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ScientificNameLabel
citronellyl formate
PHCD compound ID : 528
Chemical Names :
citronellyl formate
Molecular Formula : C11H20O2
Molecular Weight : 184.14633
More Details :
Names & Synonyms: 3,7-dimethyloct-6-enyl formate , formic acid 3,7-dimethyloct-6-enyl ester , 3,7-dimethyloct-6-enyl methanoate
Smiles: O=COCC[C@H](CCC=C(C)C)C
InChi : InChI=1S/C11H20O2/c1-10(2)5-4-6-11(3)7-8-13-9-12/h5,9,11H,4,6-8H2,1-3H3/t11-/m0/s1
InChi Key : InChIKey=DZNVIZQPWLDQHI-NSHDSACASA-N
PubChem ID : 7778
Rotatable bond count : 7 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.315658
Hydrogen bond donor count : 0 Electric dipole moment : 2.570
XLogP : 3.79 VDW volume : 211.119826
Molecular weight : 184.14633 HOMO-LUMO gap : 10.272000
Herb list :
Refrences & Litretures:
  
31.      Journal:'Global Journal of Pharmacology'      Year:'2013'      Volume:'7'      Page:'377'      DOI:'10.5829/idosi.gjp.2013.7.4.1114'      Title:'Steryl Glycosides, Lipoidal Matter and Volatile Constituents of Urtica pilulifera'
239.      Journal:'J. Agric. Food Chem'      Year:'2011'      Volume:'59'      Page:'11367'      DOI:'10.1021/jf202277w'      Title:'Artemisia dracunculus L. (Tarragon): A Critical Review of Its Traditional Use, Chemical Composition, Pharmacology, and Safety'
525.      Journal:'J. Chem. Pharm. Res'      Year:'2010'      Volume:'2'      Page:'284'      DOI:''      Title:'Essential oil composition of Hypericum perforatum L. and Hypericum scabrum L. growing wild in Tajikistan'
530.      Journal:'J. Agric. Food Chem'      Year:'2003'      Volume:'51'      Page:'3840'      DOI:'10.1021/jf021187b'      Title:'Sensory and Instrumental Evaluation of Catnip (Nepeta cataria L.) Aroma'
632.      Journal:'J. Med. Plants Res'      Year:'2012'      Volume:'6'      Page:'5495'      DOI:'10.5897/JMPR12.318'      Title:'Analysis of essential oil from nine distinct genotypes of Iranian Damask rose (Rosa damascena Mill)'
634.      Journal:'Chemistry of Natural Compounds'      Year:'2009'      Volume:'45'      Page:'110'      DOI:''      Title:'CHEMICAL COMPOSITION OF THE ESSENTIAL OILS OF Rosa damascena FROM TWO DIFFERENT LOCATIONS IN IRAN'
669.      Journal:'American Journal of Essential Oils and Natural Products'      Year:'2014'      Volume:'2'      Page:'8'      DOI:''      Title:'Comparative analysis of essential oils of Citrus aurantifolia Swingle and Citrus reticulata Blanco, from two different localities of Lagos State, Nigeria'
674.      Journal:'Rev Bras Farmacogn'      Year:'2014'      Volume:'24'      Page:'25'      DOI:'10.1590/0102-695X2014241434'      Title:'Analysis of essential oils of Origanum vulgare from six production areas of China and Pakistan'
877.      Journal:'Journal of Applied Pharmaceutical Science'      Year:'2014'      Volume:'4'      Page:'1'      DOI:'10.7324/JAPS.2014.40301'      Title:'Chemical composition, antifungal and antioxidant activity of Pelargonium graveolens essential oil'
878.      Journal:'Iran J Microbiol'      Year:'2012'      Volume:'4'      Page:'171'      DOI:''      Title:'Antibacterial activity and composition of essential oils from Pelargonium graveolens L’Her and Vitex agnus-castus L'
879.      Journal:'Journal of Essential Oil Research'      Year:'2013'      Volume:'25'      Page:'372'      DOI:'10.1080/10412905.2013.782476'      Title:'Essential oil composition of Pelargonium graveolens L’Her ex Ait. cultivars harvested in different seasons'
880.      Journal:'Phytother. Res'      Year:'2013'      Volume:'27'      Page:'1206'      DOI:'10.1002/ptr.4853'      Title:'Chemical composition and biological activities of polar extracts and essential oil of rose-scented geranium, Pelargonium graveolens'
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