1.0 2010-04-08 22:14:09 UTC 2026-09-18 18:09:48 UTC FDB019133 Linalyl acetate Isolated from numerous plants and essential oils, e.g. clary sage, lavender, lemon etc. Flavouring ingredient Linalyl acetate is a naturally-occurring phytochemical found in many flowers and spice plants. It is one of the principal components of the essential oils of bergamot and lavender. Chemically, it is the acetate ester of linalool, and the two often occur in conjunction. (-)-S-Linalyl acetate (+)-1,5-Dimethyl-1-vinylhex-4-enyl acetate (1)-1,5-Dimethyl-1-vinylhex-4-enyl acetate (r)-linalyl acetate 1,5-Dimethyl-1-vinyl-4-hexenyl acetate 1,5-dimethyl-1-vinylhex-4-en-1-yl acetate 1,6-Octadien-3-ol, 3, 7-dimethyl-, acetate 1,6-Octadien-3-ol, 3,7-dimethyl-, 3-acetate 1,6-Octadien-3-ol, 3,7-dimethyl-, 3-acetate, (3R)- 1,6-Octadien-3-ol, 3,7-dimethyl-, acetate 1,6-Octadien-3-ol, 3,7-dimethyl-, acetate, (3R)- 3,7-Dimethyl-1,6-ctadien-3-ol acetate 3,7-Dimethyl-1,6-octadien-3-ol acetate 3,7-Dimethyl-1,6-octadien-3-yl acetate 3,7-Dimethyl-3-acetate(3R)-1,6-octadien-3-ol 3,7-Dimethyl-acetate(3R)-1,6-octadien-3-ol Acetic acid linalool ester Aetic acid linalool ester Bergamiol Bergamol Bergamot mint oil Dehydrolinalool, acetate Ex bois de rose (synthetic) FEMA 2636 Licareol acetate Linalol acetate Linalool acetate Linalyl acetate Linalyl acetate synthetic Lynalyl acetate Phanteine C12H20O2 196.286 196.146329884 3,7-dimethylocta-1,6-dien-3-yl acetate linalyl acetate 115-95-7 CC(C)=CCCC(C)(OC(C)=O)C=C InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3 UWKAYLJWKGQEPM-UHFFFAOYSA-N belongs to the class of organic compounds known as acyclic monoterpenoids. These are monoterpenes that do not contain a cycle. Acyclic monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aliphatic acyclic compounds Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Acyclic monoterpenoid Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound acetate ester monoterpenoid logp 4.03 ALOGPS logs -3.51 ALOGPS solubility 6.09e-02 g/l ALOGPS melting_point < 25 oC logp 3.09 ChemAxon pka_strongest_basic -7 ChemAxon iupac 3,7-dimethylocta-1,6-dien-3-yl acetate ChemAxon average_mass 196.286 ChemAxon mono_mass 196.146329884 ChemAxon smiles CC(C)=CCCC(C)(OC(C)=O)C=C ChemAxon formula C12H20O2 ChemAxon inchi InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3 ChemAxon inchikey UWKAYLJWKGQEPM-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 59.36 ChemAxon polarizability 23.21 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 322 Specdb::CMs 2927 Specdb::CMs 26958 Specdb::CMs 26959 Specdb::CMs 28674 Specdb::CMs 28809 Specdb::CMs 102019 Specdb::CMs 102020 Specdb::CMs 102021 Specdb::CMs 102022 Specdb::CMs 152961 Specdb::MsIr 8183 Specdb::MsIr 8184 Specdb::NmrOneD 2168 Specdb::NmrOneD 2856 Specdb::NmrOneD 246888 Specdb::NmrOneD 246889 Specdb::NmrOneD 246890 Specdb::NmrOneD 246891 Specdb::NmrOneD 246892 Specdb::NmrOneD 246893 Specdb::NmrOneD 246894 Specdb::NmrOneD 246895 Specdb::NmrOneD 246896 Specdb::NmrOneD 246897 Specdb::NmrOneD 246898 Specdb::NmrOneD 246899 Specdb::NmrOneD 246900 Specdb::NmrOneD 246901 Specdb::NmrOneD 246902 Specdb::NmrOneD 246903 Specdb::NmrOneD 246904 Specdb::NmrOneD 246905 Specdb::NmrOneD 246906 Specdb::NmrOneD 246907 Specdb::MsMs 63669 Specdb::MsMs 63670 Specdb::MsMs 63671 Specdb::MsMs 120648 Specdb::MsMs 120649 Specdb::MsMs 120650 Specdb::MsMs 2772053 Specdb::MsMs 2772054 Specdb::MsMs 2772055 Specdb::MsMs 2910635 Specdb::MsMs 2910636 Specdb::MsMs 2910637 HMDB39522 #<Reference:0x0000558be77f65c0> Cardamom Type 1 specific Elettaria cardamomum 105181 459.85 459.85 459.85 mg/100 g Celery stalks Type 1 Plant Apium graveolens var. dulce 117781 Ceylon cinnamon Type 1 specific Cinnamomum verum 128608 Common oregano Type 1 specific Origanum vulgare 39352 9.6 9.6 9.6 mg/100 g Common sage Type 1 specific Salvia officinalis 38868 302.4 302.4 302.4 mg/100 g Common thyme Type 1 specific Thymus vulgaris 49992 234.75 234.75 234.75 mg/100 g Coriander Type 1 specific Coriandrum sativum 4047 Cornmint Type 1 Plant Mentha arvensis 292239 145.25 145.25 145.25 mg/100 g Dill Type 1 specific Anethum graveolens 40922 Fig Type 1 specific Ficus carica 3494 Herbs and Spices Unknown generic Lemon Type 1 Plant Citrus limon 2708 Lemon grass Type 1 Plant Cymbopogon citratus 66014 Lime Type 1 Plant Citrus aurantiifolia 159033 Linden Type 1 specific Tilia 64580 Mugwort Type 1 specific Artemisia vulgaris 4220 Nutmeg Type 1 specific Myristica fragrans 51089 Orange mint Type 1 specific Mentha aquatica 190902 Pepper (Spice) Type 1 specific Piper nigrum 13216 Pot marjoram Type 1 specific Origanum onites 452416 0.0 0.0 0.0 mg/100 g Rabbiteye blueberry Type 1 specific Vaccinium virgatum Rosemary Type 1 specific Rosmarinus officinalis 39367 9.2 9.2 9.2 mg/100 g Saffron Type 1 specific Crocus sativus 82528 Spearmint Type 1 specific Mentha spicata 29719 Sunflower Type 1 specific Helianthus annuus 4232 Sweet basil Type 1 specific Ocimum basilicum 39350 12.75 12.75 12.75 mg/100 g Sweet bay Type 1 specific Laurus nobilis 85223 Sweet marjoram Type 1 specific Origanum majorana 268884 1.0 1.0 1.0 mg/100 g Wild celery Type 1 specific Angelica archangelica 4045 Winter savory Type 1 specific Satureja montana 49988 12.15 12.15 12.15 mg/100 g bergamot citrus fruit green lavender sweet woody Cytochrome P450 2A6 P11509 CP2A6_HUMAN CYP2A6 Histidine decarboxylase P19113 HDC Analgesic 56 An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. Anesthetic 62 Anti bacterial 145 A substance that kills or slows the growth of bacteria. Anti carcinogenic 161 A substance that inhibits or prevents the proliferation of neoplasms. Anti depressant 223 Any substance introduced into a living organism with therapeutic or diagnostic purpose. Anti microbial 436 A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. Anti-inflammatory 370 A substance that reduces or suppresses inflammation. Anti-oxidant 502 A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. In European countries, E-numbers for permitted antioxidant food additives are from E 300 to E 324. Anti-spasmodic 619 Any substance introduced into a living organism with therapeutic or diagnostic purpose. Anti-Zika virus 1441 Anxiolytic 698 Anxiolytic drugs are agents that alleviate anxiety, tension, and anxiety disorders, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions. Bactericide 722 A substance that kills or slows the growth of bacteria. Cytotoxic 859 A role played by the molecular entity or part thereof which causes the development of a pathological process. Flavor 936 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. Hepatotoxic 984 A role played by a chemical compound exihibiting itself through the ability to induce damage to the liver in animals. Inhibitor 1432 A substance that diminishes the rate of a chemical reaction. Insecticide 1040 Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. Motor depressant 1118 Neuroprotective 1158 Any compound that can be used for the treatment of neurodegenerative disorders. Perfumery 1206 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. Repellent 1283 Sedative 1311 A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety. Toxic 1371 A role played by the molecular entity or part thereof which causes the development of a pathological process.