3-Otenol

ScientificNameLabel

3-Otenol
PHCD compound ID :	101
Chemical Names :	3-octanol , Octan-3-ol , 3-Otenol , 3-Otanol , Ethylamylcarbinol , 3-Octanal , 3Octanol , Octyl 3-alcohol
Molecular Formula :	C8H18O1
Molecular Weight :	130.135765

More Details :

Names & Synonyms:	octan-3-ol , 3-octanol
Smiles:	CCCCC[C@@H](CC)O
InChi :	InChI=1S/C8H18O/c1-3-5-6-7-8(9)4-2/h8-9H,3-7H2,1-2H3/t8-/m1/s1
InChi Key :	InChIKey=NMRPBPVERJPACX-MRVPVSSYSA-N
PubChem ID :	11527

Rotatable bond count :	5	Rule of five :	0
Hydrogen bond acceptor count :	1	Ionization potential :	10.394213
Hydrogen bond donor count :	1	Electric dipole moment :	1.880
XLogP :	2.807	VDW volume :	155.714562
Molecular weight :	130.135765	HOMO-LUMO gap :	13.379000

Herb list :

- Thymus daenensis - آویشن دنائی

Balanga - Lallemantia royleana - بالنگوی شیرازی

Balanga, Bragon's head - Lallemantia iberica - بالنگوی شهری

Betony - Stachys lavandulifolia Vahl - چای کوهی، سنبله ای زیبا

Church steeple - Agrimonia eupatoria - غافث

Great mullein, Flannel mullein - Verbascum thapsus - گل ماهور اروپائی

Horehound - Marrubium vulgare L - فراسیون

Horsemint, Brookmint - Mentha longifolia - پونه، پودنه

Jujube - Ziziphus jujuba - عناب

Kotschyam thyme - Thymus kotschyanus - آويشن

Lavender - Lavandula angustifolia - اسطوخودوس

Lemon verbena, Lippia - Lippia citriodora - به ليمو

Moldavian balm, Moldavian dragon head - Dracocephalum moldavica - بادرشبی، بادرنجبویه، شاطرامرزه

Mugwort, Mugwood - Artemisia vulgaris - برنجاسف، درمنه معمولی

Origanum, Marjoram - Origanum vulgare - مرزنجوش، مرزنگوش

Penny royal, Flea mint - Mentha pulegium - پونه معطر، خال واش، کوت کوتی

Peppermint - Mentha piperita - نعنا فلفلی، نعنا

Poleygermander - Teucrium polium - کلپوره، مریم نخودی

Pumpkin, Gourd - Cucurbita pepo - کدومسمایی

Red pepper - Capsicum annuum - فلفل قرمز

Saatar, Zataria - Zataria multiflora - آویشن شیرازی، ازکند

Spear mint - Mentha spicata - نعنا دشتی، پونه سنبله ای، نعناع

Strawberry - Fragaria vesca - توت فرنگی

Thyme, Garden thyme - Thymus vulgaris - آويشن باغی

Wormwood - Artemisia sieberi - درمنه

Yellow sweet clover, Yellow melilot - Melilotus officinalis - یونجه زرد، اکلیل الملک

Ziziphora - Ziziphora tenuior - کاکوتی

Refrences & Litretures:


6. Journal:'Photochemistry and Photobiology' Year:'2014' Volume:'90' Page:'702' DOI:'10.1111/php.12229' Title:'Biochemical Composition and Antioxidant Properties of Lavandula angustifolia Miller Essential Oil are Shielded by Propolis Against UV Radiations'
9. Journal:'Food Chemistry' Year:'2009' Volume:'112' Page:'1072' DOI:'10.1016/j.foodchem.2008.07.015' Title:'Flavour compounds of Lavandula angustifolia L. to use in food manufacturing: Comparison of three different extraction methods'
11. Journal:'Analytica Chimica Acta' Year:'2006' Volume:'555' Page:'157' DOI:'10.1016/j.aca.2005.08.071' Title:'Microwave accelerated steam distillation of essential oil from lavender: A rapid, clean and environmentally friendly approach'
65. Journal:'Middle-East J. Sci. Res' Year:'2014' Volume:'21' Page:'1670' DOI:'' Title:'Chemical Composition, Antioxidant and Antitumor Activity of Thymus vulgaris L. Essential Oil'
66. Journal:'Food Chemistry' Year:'2008' Volume:'109' Page:'925' DOI:'10.1016/j.foodchem.2007.12.084' Title:'Comparison of microwave-assisted hydrodistillation with the traditional hydrodistillation method in the extraction of essential oils from Thymus vulgaris L'
71. Journal:'Food Chemistry' Year:'2005' Volume:'91' Page:'131' DOI:'10.1016/j.foodchem.2004.05.056' Title:'Identi?cation of volatile components in basil (Ocimum basilicum L.) and thyme leaves (Thymus vulgaris L.) and their antioxidant properties'
72. Journal:'Industrial Crops and Products' Year:'2006' Volume:'24' Page:'253' DOI:'10.1016/j.indcrop.2006.06.011' Title:'Seasonal variation of Thymus hyemalis Lange and Spanish Thymus vulgaris L. essential oils composition'
73. Journal:'J. Sep. Sci' Year:'2009' Volume:'32' Page:'3034' DOI:'10.1002/jssc.200900214' Title:'Static and dynamic superheated water extraction of essential oil components fromThymus vulgaris L'
77. Journal:'Annals of Biological Research' Year:'2012' Volume:'3' Page:'1443' DOI:'' Title:'Comparative Study of the Essential Oil Chemical Composition of Thymus Kotschyanus Boiss. & Hohen var. kotschyanus from Iran'
78. Journal:'Evidence-Based Complementary and Alternative Medicine' Year:'2012' Volume:'2012' Page:'1' DOI:'10.1155/2012/728065' Title:'Essential Oils Composition and Antioxidant Properties of Three Thymus Species'
80. Journal:'Journal of Essential Oil Bearing Plants' Year:'2013' Volume:'16' Page:'117' DOI:'10.1080/0972060X.2013.764159' Title:'Essential Oil Compositions of Thymus kotschyanus Boiss. Obtained by Hydrodistillation and Microwave Oven Distillation'
82. Journal:'Journal of Medicinal Plants' Year:'2011' Volume:'10' Page:'12' DOI:'' Title:'Application of Satureja hortensis L. and Zataria multiflora Boiss. Essential Oils as Two Natural Antioxidants in Soybean Oil During Microwave Heating'
85. Journal:'Food and Chemical Toxicology' Year:'2010' Volume:'48' Page:'1562' DOI:'10.1016/j.fct.2010.03.025' Title:'Chemical composition of essential oils in Zataria multi?ora Boiss. From different parts of Iran and their radical scavenging and antimicrobial activity'
90. Journal:'Food Control' Year:'2007' Volume:'18' Page:'800' DOI:'10.1016/j.foodcont.2006.04.002' Title:'In vitro evaluation of antibacterial and antioxidant activities of the essential oil and methanol extract of endemic Zataria multi?ora Boiss'
91. Journal:'Eur. J. Lipid Sci. Technol' Year:'2008' Volume:'110' Page:'448' DOI:'10.1002/ejlt.200700239' Title:'Microwave-assisted hydrodistillation of essential oil from Zataria multiflora Boiss'
108. Journal:'Journal of Medicinal Plants Studies' Year:'2015' Volume:'3' Page:'61' DOI:'' Title:'Changes in content and chemical composition of Dracocephalum moldavica L. essential oil at different harvest dates'
111. Journal:'Pharmaceutical sciences' Year:'2013' Volume:'18' Page:'187' DOI:'' Title:'Chemical Composition and Antinociceptive Effect of the Essential Oil of Dracocephalum moldavica L'
136. Journal:'J. Essent. Oil Res' Year:'2006' Volume:'18' Page:'164' DOI:'10.1080/10412905.2006.9699055' Title:'Essential Oil Composition of Lallemantia iberica Fisch. et C.A. Mey'
137. Journal:'Flavour Fragr. J' Year:'2003' Volume:'18' Page:'237' DOI:'10.1002/ffj.1215' Title:'Compositional analysis of the essential oil of Lallemantia royleana (Benth. in Wall.) Benth. from Iran'
158. Journal:'JOURNAL OF BIOSCIENCE AND BIOENGINEERING' Year:'2008' Volume:'105' Page:'176' DOI:'10.1263/jbb.105.176' Title:'Mass Propagation and Essential Oil Analysis of Artemisia vulgaris'
168. Journal:'European Journal of Experimental Biology' Year:'2012' Volume:'2' Page:'1771' DOI:'' Title:'Essential oil content and composition of Lippa citriodora as affected by drying method before flowering stages'
218. Journal:'Journal of Essential Oil Research' Year:'2013' Volume:'25' Page:'430' DOI:'10.1080/10412905.2013.829005' Title:'Chemical diversity in essential oil composition of Mentha longifolia (L.) Hudson subsp. typhoides (Briq.) Harley var. typhoides from Turkey'
220. Journal:'Journal of Medicinal Plants Research' Year:'2012' Volume:'6' Page:'4522' DOI:'10.5897/JMPR11.933' Title:'Essential oil content and composition of Mentha longifolia (L.) Hudson grown wild in Iran'
222. Journal:'Journal of Herbal Drugs' Year:'2014' Volume:'5' Page:'33' DOI:'' Title:'Essential oil composition of Pennyroyal (Mentha pulegium L.) from Southern Iran'
224. Journal:'Industrial Crops and Products' Year:'2012' Volume:'36' Page:'81' DOI:'10.1016/j.indcrop.2011.08.011' Title:'European pennyroyal (Mentha pulegium) from Portugal: Chemical composition of essential oil and antioxidant and antimicrobial properties of extracts and essential oil'
225. Journal:'Industrial Crops and Products' Year:'2009' Volume:'30' Page:'338' DOI:'10.1016/j.indcrop.2009.06.003' Title:'Salt effect on yield and composition of shoot essential oil and trichome morphology and density on leaves of Mentha pulegium'
227. Journal:'World J Microbiol Biotechnol' Year:'2009' Volume:'25' Page:'2227' DOI:'10.1007/s11274-009-0130-3' Title:'Biological activities of the essential oils and methanol extract of tow cultivated mint species (Mentha longifolia and Mentha pulegium) used in the Tunisian folkloric medicine'
228. Journal:'Food Research International' Year:'2012' Volume:'45' Page:'313' DOI:'10.1016/j.foodres.2011.09.004' Title:'Evaluation of the chemical composition and antimicrobial activity of Mentha pulegium, Juniperus phoenicea, and Cyperus longus essential oils from Morocco'
262. Journal:'J Sci Food Agric' Year:'1997' Volume:'74' Page:'421' DOI:'' Title:'Strawberry Flavour: Analysis and Biosynthesis'
285. Journal:'Journal of Herbal Drugs' Year:'2013' Volume:'4' Page:'137' DOI:'' Title:'Phytochemical of essential oil of Stachys lavandulifolia Vahl. collected from a natural habitat in western Isfahan, Iran'
314. Journal:'Journal of Essential Oil Bearing Plants' Year:'2012' Volume:'15' Page:'373' DOI:'10.1080/0972060X.2012.10644063' Title:'Chemical Composition and Antimicrobial Activity of the Essential Oil of Verbascum thapsus L'
330. Journal:'Journal of Stored Products Research' Year:'2007' Volume:'43' Page:'123' DOI:'10.1016/j.jspr.2006.02.002' Title:'Fumigant toxicity of essential oil from Artemisia sieberi Besser against three stored-product insects'
498. Journal:'Journal of Essential Oil Bearing Plants' Year:'2010' Volume:'13' Page:'313' DOI:'10.1080/0972060X.2010.10643826' Title:'Chemical Composition of the Leaves Essential Oil of Melilotus officinalis (L.) Pallas from Colombia'
533. Journal:'Analyst' Year:'2013' Volume:'138' Page:'6881' DOI:'10.1039/c3an01478a' Title:'Phytochemical analyses of Ziziphus jujuba Mill. var. spinosa seed by ultrahigh performance liquid chromatography-tandem mass spectrometry and gas chromatography-mass spectrometry'
536. Journal:'Journal of Analytical Methods in Chemistry' Year:'2013' Volume:'' Page:'246986' DOI:'10.1155/2013/246986' Title:'Comparative Analysis of the Volatile Components of Agrimonia eupatoria from Leaves and Roots by Gas Chromatography-Mass Spectrometry and Multivariate Curve Resolution'
542. Journal:'Folia Pomer. Univ. Technol. Stetin., Agric., Aliment., Pisc., Zootech' Year:'2015' Volume:'320' Page:'95' DOI:'' Title:'GC-MS ANALYSIS OF ESSENTIAL OILS ISOLATED FROM FRUITS OF CHOSEN HOT PEPPER (CAPSICUM ANNUUM L.) CULTIVARS'
575. Journal:'J. Chin. Chem. Soc' Year:'2013' Volume:'60' Page:'649' DOI:'10.1002/jccs.201300133' Title:'Improvement of GC-MS Analysis of Shahrbabak Ziziphora tenuior Essential Oil by Using Multivariate Curve Resolution Approaches'
587. Journal:'Leffingwell Reports' Year:'2015' Volume:'7' Page:'1' DOI:'' Title:'Identification of the Volatile Constituents of Raw Pumpkin (Cucurbita pepo L.) by Dynamic Headspace Analyses'
597. Journal:'J. Agr. Sci. Tech' Year:'2015' Volume:'17' Page:'705' DOI:'' Title:'Morpho-chemical Diversity among Iranian Teucrium poliumL. (Lamiaceae) Populations in Fars Province'
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'
675. Journal:'Food Control' Year:'2004' Volume:'15' Page:'549' DOI:'10.1016/j.foodcont.2003.08.009' Title:'Biological activities of the essential oils and methanol extract of Origanum vulgare ssp. vulgare in the Eastern Anatolia region of Turkey'
678. Journal:'Molecules' Year:'2013' Volume:'18' Page:'14948' DOI:'10.3390/molecules181214948' Title:'Chemical Composition and Biological Activity of Essential Oils of Origanum vulgare L. subsp. vulgare L. under Different Growth Conditions'
679. Journal:'Natural Product Research' Year:'2012' Volume:'26' Page:'140' DOI:'10.1080/14786419.2010.535150' Title:'Chemical markers in Origanum vulgare L. from Kumaon Himalayas: a chemosystematic study'
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'
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'
778. Journal:'Industrial Crops and Products' Year:'2013' Volume:'49' Page:'97' DOI:'10.1016/j.indcrop.2013.04.029' Title:'Influence of storage conditions on the essential oil composition ofThymus daenensis Celak'
915. Journal:'International Journal of Plant Science and Ecology' Year:'2015' Volume:'1' Page:'138' DOI:'' Title:'Essential Oil Composition of Marrubium vulgare L. Cultivated in Egypt'