Methyl salicylate

ScientificNameLabel

Methyl salicylate
PHCD compound ID :	599
Chemical Names :	Methyl salicylate , Methyl methylsalicilate , Methyl salycilate
Molecular Formula :	C8H8O3
Molecular Weight :	152.047344

More Details :

Names & Synonyms:	methyl 2-hydroxybenzoate , 2-hydroxybenzoic acid methyl ester , methyl 2-oxidanylbenzoate
Smiles:	COC(=O)c1ccccc1O
InChi :	InChI=1S/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H3
InChi Key :	InChIKey=OSWPMRLSEDHDFF-UHFFFAOYSA-N
PubChem ID :	4133

Rotatable bond count :	2	Rule of five :	0
Hydrogen bond acceptor count :	3	Ionization potential :	9.535237
Hydrogen bond donor count :	1	Electric dipole moment :	2.709
XLogP :	1.229	VDW volume :	139.492722
Molecular weight :	152.047344	HOMO-LUMO gap :	9.029000

Herb list :

Caper - Capparis spinosa - کبر، لگجی، علف مار، کور

Clove - Eugenia caryophyllata - میخک هندی، میخک

Cubeb pepper, Cubeb - Piper cubeba - کبابه، کبابه چینی

Dog rose, Briar rose, Hip-rose - Rosa canina - نسترن وحشی، گل سگ

Egyptian willow - Salix aegyptiaca - بيدمشك

Fig - Ficus carica - انجیر، شال انجیر

Henna - Lawsonia inermis - حنا

Liverwort, Common polypody, Wall fern - Polypodium vulgare - بسفایج

Purging cassia, Drumstick tree - Cassia fistula - فلوس

Quince, Apple quince - Cydonia oblonga - به، شال به، به جنگلی

Red pepper - Capsicum annuum - فلفل قرمز

Rue - Ruta graveolens - سداب

Small-leaved linden, Tillet tree - Tilia cordata - زیرفون، نمدار برگ‌ریز

Strawberry - Fragaria vesca - توت فرنگی

Tamarind, Indian date - Tamarindus indica - تمرهندی

Tea - Camellia sinensis - چای

Tobacco - Nicotina tabacum - تنباکو

Violet - Viola odorata - بنفشه معطر، بنفشه

Wild pansy, Heartsease, Pansy - Viola tricolor L - بنفشه سه‌رنگ

Refrences & Litretures:


35. Journal:'Food Chemistry' Year:'2010' Volume:'123' Page:'548' DOI:'10.1016/j.foodchem.2010.04.064' Title:'Volatile pro?ling of Ficus carica varieties by HS-SPME and GC–IT-MS'
36. Journal:'Journal of Essential Oil Bearing Plants' Year:'2010' Volume:'13' Page:'316' DOI:'10.1080/0972060X.2010.10643827' Title:'Volatile Constituents of Leaves of Ficus carica Linn. Grown in Egypt'
37. Journal:'J. Agric. Food Chem' Year:'2010' Volume:'58' Page:'3393' DOI:'10.1021/jf9039759' Title:'Chemical Assessment and in Vitro Antioxidant Capacity of Ficus carica Latex'
160. Journal:'Natural Product Research' Year:'2012' Volume:'26' Page:'802' DOI:'10.1080/14786419.2011.558013' Title:'Composition of essential oil and biological activity of extracts of Viola odorata L. from central Iran'
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'
183. Journal:'Journal of Essential Oil Bearing Plants' Year:'2011' Volume:'14' Page:'543' DOI:'10.1080/0972060X.2011.10643971' Title:'Chemical Compositions of Salix aegyptiaca. L. Obtained by Simultaneous Hydrodistilation and Extraction'
251. Journal:'Journal of Essential Oil Research' Year:'2004' Volume:'16' Page:'318' DOI:'10.1080/10412905.2004.9698731' Title:'Volatile Components of Tamarind (Tamarindus indica L.) Grown in Cuba'
262. Journal:'J Sci Food Agric' Year:'1997' Volume:'74' Page:'421' DOI:'' Title:'Strawberry Flavour: Analysis and Biosynthesis'
264. Journal:'J. Agric. Food Chem' Year:'1990' Volume:'38' Page:'455' DOI:'' Title:'Headspace Compounds from Flowers of Nicotiana tabacum and Related Species'
265. Journal:'J. Agric. Food Chem' Year:'1988' Volume:'36' Page:'295' DOI:'' Title:'Green Leaf Headspace Volatiles from Nicotiana tabacum Lines of Different Trichome Morphology'
290. Journal:'Journal of Essential Oil Research' Year:'1995' Volume:'7' Page:'425' DOI:'10.1080/10412905.1995.9698554' Title:'Volatile Components of Lawsonia inermis L. Flowers'
430. Journal:'Phytochemistry' Year:'2002' Volume:'61' Page:'573' DOI:'' Title:'Potential allelochemicals from the essential oil of Ruta graveolens'
544. Journal:'International Journal of Food Properties' Year:'2013' Volume:'16' Page:'18' DOI:'10.1080/10942912.2010.513616' Title:'Pakistani Bell Pepper (Capsicum annum L.): Chemical Compositions and its Antioxidant Activity'
548. Journal:'J. Essent. Oil Res' Year:'2007' Volume:'19' Page:'360' DOI:'10.1080/10412905.2007.9699305' Title:'Essential Oil from the Flowers and Leaves of Cassia fstula L'
577. Journal:'J. Essent. Oil Res' Year:'2007' Volume:'19' Page:'14' DOI:'10.1080/10412905.2007.9699217' Title:'Essential Oil Constituents of Piper cubeba L. fils. from Indonesia'
581. Journal:'Journal of Food Biochemistry' Year:'2010' Volume:'34' Page:'286' DOI:'10.1111/j.1745-4514.2009.00330.x' Title:'EVALUATION OF THE ANTIOXIDANT ACTIVITY OF ESSENTIAL OILS FROM CAPER (CAPPARIS SPINOSA) AND SEA FENNEL (CRITHMUM MARITIMUM) BY DIFFERENT METHODS'
582. Journal:'Food Chemistry' Year:'2007' Volume:'101' Page:'1272' DOI:'10.1016/j.foodchem.2005.12.029' Title:'Flavour pro?le of capers (Capparis spinosa L.) from the Eolian Archipelago by HS-SPME/GC–MS'
583. Journal:'Food Chemistry' Year:'2012' Volume:'132' Page:'261' DOI:'10.1016/j.foodchem.2011.10.074' Title:'The anticarcinogenic potential of essential oil and aqueous infusion from caper (Capparis spinosa L.)'
704. Journal:'Journal of Biologically Active Products from Nature' Year:'2015' Volume:'5' Page:'1' DOI:'' Title:'Chemical Composition and Antimicrobial Activity of the Essential Oil of Eugenia caryophyllata Cloves Extracted by Conventional and Microwave Techniques'
707. Journal:'Journal of Essential Oil Bearing Plants' Year:'2015' Volume:'18' Page:'967' DOI:'10.1080/0972060X.2014.884779' Title:'Chemical Composition, Antimicrobial andAntioxidant Activities of Eugenia caryophyllata Essential Oil'
714. Journal:'African Journal of Biotechnology' Year:'2010' Volume:'9' Page:'2709' DOI:'' Title:'Phenols, essential oils and carotenoids of Rosa canina from Tunisia and their antioxidant activities'
715. Journal:'Z Naturforsch C' Year:'2005' Volume:'60' Page:'369' DOI:'' Title:'Chemical Composition of Hips Essential Oils of Some Rosa L. Species'
814. Journal:'Natural Products: An Indian Journal' Year:'2013' Volume:'9' Page:'16' DOI:'' Title:'Comparison investigation of essential oils in tea (Camellia sinensis L.var. sinensis) clones'
874. Journal:'CHEMIJA' Year:'2007' Volume:'18' Page:'44' DOI:'' Title:'Influence of urban environment on chemical composition of essential oil of Tilia cordata'
932. Journal:'Chemistry of Natural Compounds' Year:'2009' Volume:'45' Page:'91' DOI:'10.1007/s10600-009-9244-y' Title:'Composition of essential oils of Viola tricolor and V. arvensis from Romania'
950. Journal:'International Journal of Unani and Integrative Medicine 2017; 1(2): 04' Year:'2017' Volume:'1' Page:'4' DOI:'' Title:'Bisfayej (Polypodium vulgare L.): A review on medicinal importance of rhizome with Unani prospective and modern pharmacology'