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ScientificNameLabel
Dihydrocarvyl-acetate
PHCD compound ID : 486
Chemical Names :
Dihydrocarveyl acetate , Dihydrocarvyl-acetate , Dihydrocarvyl acetate , neoisodihydrocarveol acetate , 2-Methyl-5-(1-methylethenyl)-cyclohexyl acetate , Carvyl-dihydro-acetate-iso , Dihydrocarveol acetate
Molecular Formula : C12H20O2
Molecular Weight : 196.14633
More Details :
Names & Synonyms: (5-isopropenyl-2-methyl-cyclohexyl) acetate , acetic acid [2-methyl-5-(1-methylethenyl)cyclohexyl] ester , (2-methyl-5-prop-1-en-2-ylcyclohexyl) acetate , (2-methyl-5-prop-1-en-2-yl-cyclohexyl) ethanoate , acetic acid (5-isopropenyl-2-methyl-cyclohexyl) ester
Smiles: CC(=O)O[C@H]1C[C@@H](CC[C@H]1C)C(=C)C
InChi : InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9-,11-,12+/m1/s1
InChi Key : InChIKey=TUSIZTVSUSBSQI-JLLWLGSASA-N
PubChem ID : 30248
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.698195
Hydrogen bond donor count : 0 Electric dipole moment : 2.553
XLogP : 3.135 VDW volume : 216.059352
Molecular weight : 196.14633 HOMO-LUMO gap : 10.916000
Herb list :
Refrences & Litretures:
  
30.      Journal:'Phytochemistry'      Year:'2005'      Volume:'66'      Page:'507'      DOI:'10.1016/j.phytochem.2005.01.007'      Title:'Identi?cation of an EcoRI restriction site for a rapid and precise determination of ?-asarone-free Acorus calamus cytotypes'
45.      Journal:'Can. J. Plant Sci'      Year:'1977'      Volume:'57'      Page:'681'      DOI:''      Title:'ESSENTIAL OILS FROM SPICES GROWN IN ALBERTA. ANISE OIL (PIMPINELLA ANISUM)'
138.      Journal:'Journal of Food Safety'      Year:'2014'      Volume:''      Page:'1'      DOI:'10.1111/jfs.12139'      Title:'CHEMICAL COMPOSITION, ANTIFUNGAL AND ANTIBACTERIAL ACTIVITIES OF ESSENTIAL OIL FROM LALLEMANTIA ROYLEANA (BENTH. IN WALL.) BENTH'
336.      Journal:'J. Agric. Food Chem'      Year:'2007'      Volume:'55'      Page:'9124'      DOI:'10.1021/jf071646e'      Title:'Chemical Composition of the Volatile Extract and Antioxidant Activities of the Volatile and Nonvolatile Extracts of Egyptian Corn Silk (Zea mays L.)'
711.      Journal:'Food Chemistry'      Year:'2001'      Volume:'74'      Page:'443'      DOI:''      Title:'Antioxidant property of aroma extract isolated from clove buds [Syzygium aromaticum (L.) Merr. et Perry]'
716.      Journal:'Int. J. Electrochem. Sci'      Year:'2011'      Volume:'6'      Page:'691'      DOI:''      Title:'Chemical Composition and Inhibitory Effect of Mentha Spicata Essential Oil on the Corrosion of Steel in Molar Hydrochloric Acid'
718.      Journal:'J. Agric. Food Chem'      Year:'1998'      Volume:'46'      Page:'1739'      DOI:'10.1021/jf9708296'      Title:'Antifungal Activities of Origanum vulgare subsp. hirtum, Mentha spicata, Lavandula angustifolia, and Salvia fruticosa Essential Oils against Human Pathogenic Fungi'
723.      Journal:'Songklanakarin J. Sci. Technol'      Year:'2014'      Volume:'36'      Page:'83'      DOI:''      Title:'Chemical composition and antimicrobial activity of peppermint (Mentha piperita L.) Essential oil'
761.      Journal:'African Journal of Biotechnology'      Year:'2011'      Volume:'10'      Page:'196'      DOI:'10.5897/AJB10.1394'      Title:'Application of Lavandula officinalis L. antioxidant of essential oils in shelf life of confectionary'
881.      Journal:'Food Chemistry'      Year:'2012'      Volume:'130'      Page:'882'      DOI:'10.1016/j.foodchem.2011.07.119'      Title:'Neuroprotective potential of some terebinth coffee brands and the unprocessed fruits of Pistacia terebinthus L. and their fatty and essential oil analyses'
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