1.0 2010-04-08 22:11:33 UTC 2019-11-26 03:11:00 UTC FDB014946 Neryl acetate Found in citrus, kumquat and pummelo peel oils, ginger, cardamon, clary sage, myrtle leaf and myrtle berries. Flavouring agent (2Z)-3,7-Dimethyl-2,6-octadienyl acetate (Z)-3,7-Dimethyl-2,6-octadienyl acetate 3,7-Dimethyl-1-acetate(2e)-2,6-octadien-1-ol 3,7-Dimethyl-1-acetate(2Z)-2,6-octadien-1-ol 3,7-Dimethyl-acetate(2e)-2,6-octadien-1-ol 3,7-Dimethyl-acetate(2Z)-2,6-octadien-1-ol 3,7-Dimethyl-acetate(e)-2,6-octadien-1-ol 3,7-Dimethyl-acetatetrans-2,6-octadien-1-ol 3,7-Dimethylocta-2,6-dienyl acetate cis-3,7-Dimethyl-2,6-octadien-1-yl acetate cis-3,7-Dimethyl-2,6-octadien-1-yl ethanoate Cis-geranyl acetate FEMA 2773 Linalyl, neryl, geranyl acetates, mixture Neryl acetate trans-3,7-Dimethyl-2,6-octadien-1-yl ethanoate C12H20O2 196.286 196.146329884 (2Z)-3,7-dimethylocta-2,6-dien-1-yl acetate neryl acetate 105-87-3 CC(C)=CCC\C(C)=C/COC(C)=O InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8- HIGQPQRQIQDZMP-FLIBITNWSA-N belongs to the class of organic compounds known as fatty alcohol esters. These are ester derivatives of a fatty alcohol. Fatty alcohol esters Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohol esters Aliphatic acyclic compounds Acyclic monoterpenoids 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 Fatty alcohol ester Hydrocarbon derivative Monocarboxylic acid or derivatives Monoterpenoid Organic oxide Organic oxygen compound Organooxygen compound Wax monoesters logp 4.11 ALOGPS logs -3.01 ALOGPS solubility 1.90e-01 g/l ALOGPS melting_point < 25 oC logp 2.94 ChemAxon pka_strongest_basic -7 ChemAxon iupac (2Z)-3,7-dimethylocta-2,6-dien-1-yl acetate ChemAxon average_mass 196.286 ChemAxon mono_mass 196.146329884 ChemAxon smiles CC(C)=CCC\C(C)=C/COC(C)=O ChemAxon formula C12H20O2 ChemAxon inchi InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8- ChemAxon inchikey HIGQPQRQIQDZMP-FLIBITNWSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 60.33 ChemAxon polarizability 23.66 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15329 Specdb::CMs 28675 Specdb::CMs 28830 Specdb::CMs 28970 Specdb::CMs 101711 Specdb::CMs 101712 Specdb::CMs 101713 Specdb::CMs 103771 Specdb::MsMs 82212 Specdb::MsMs 82213 Specdb::MsMs 82214 Specdb::MsMs 143517 Specdb::MsMs 143518 Specdb::MsMs 143519 HMDB35157 #<Reference:0x0000561272f43a50> Cardamom Type 1 specific Elettaria cardamomum 105181 Celery stalks Type 1 specific Apium graveolens var. dulce 117781 Citrus Unknown generic Common oregano Type 1 specific Origanum vulgare 39352 Common persimmon Type 1 specific Diospyros virginiana 13493 Coriander Type 1 specific Coriandrum sativum 4047 Fruits Unknown generic Herbs and Spices Unknown generic Lemon Type 1 specific Citrus limon 2708 16.3 16.3 16.3 mg/100 g Lemon balm Type 1 specific Melissa officinalis 39338 Lime Type 1 specific Citrus aurantiifolia 159033 15.55 15.55 15.55 mg/100 g Mandarin orange (Clementine, Tangerine) Type 1 specific Citrus reticulata 85571 0.55 0.55 0.55 mg/100 g Mango Type 1 specific Mangifera indica 29780 Mugwort Type 1 specific Artemisia vulgaris 4220 Nutmeg Type 1 specific Myristica fragrans 51089 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 Spearmint Type 1 specific Mentha spicata 29719 35.1 35.1 35.1 mg/100 g Sweet basil Type 1 specific Ocimum basilicum 39350 Sweet bay Type 1 specific Laurus nobilis 85223 Sweet marjoram Type 1 specific Origanum majorana 268884 Sweet orange Type 1 specific Citrus sinensis 2711 1.0 1.0 1.0 mg/100 g Wild celery Type 1 specific Apium graveolens 4045 blossom citrus dewy floral fruit grapefruit lime pear rose soapy anti flu 284 A substance that destroys or inhibits replication of viruses. anti viral 689 A substance that destroys or inhibits replication of viruses. flavor 936 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. perfumery 1206 A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell. pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.