1.0 2010-04-08 22:12:18 UTC 2015-07-20 23:27:05 UTC FDB016216 alpha-Santalyl acetate Mixts. with b-santalyl acetate are used as flavouring ingredients (+)-alpha-santalyl acetate a-Santalyl acetate Alpha-santalol acetate C17H26O2 262.3871 262.193280076 (2Z)-5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methylpent-2-en-1-yl acetate (2Z)-5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methylpent-2-en-1-yl acetate 41414-75-9 CC(=O)OC\C(C)=C/CCC1(C)C2CC3C(C2)C13C InChI=1S/C17H26O2/c1-11(10-19-12(2)18)6-5-7-16(3)13-8-14-15(9-13)17(14,16)4/h6,13-15H,5,7-10H2,1-4H3/b11-6- IXRPKRWXUJOOBZ-WDZFZDKYSA-N belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. Sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aliphatic homopolycyclic compounds Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic homopolycyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Santalane sesquiterpenoid Sesquiterpenoid logp 4.46 ALOGPS logs -5.20 ALOGPS solubility 1.64e-03 g/l ALOGPS logp 3.26 ChemAxon pka_strongest_basic -7 ChemAxon iupac (2Z)-5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methylpent-2-en-1-yl acetate ChemAxon average_mass 262.3871 ChemAxon mono_mass 262.193280076 ChemAxon smiles CC(=O)OC\C(C)=C/CCC1(C)C2CC3C(C2)C13C ChemAxon formula C17H26O2 ChemAxon inchi InChI=1S/C17H26O2/c1-11(10-19-12(2)18)6-5-7-16(3)13-8-14-15(9-13)17(14,16)4/h6,13-15H,5,7-10H2,1-4H3/b11-6- ChemAxon inchikey IXRPKRWXUJOOBZ-WDZFZDKYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 76.62 ChemAxon polarizability 30.81 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10285 Specdb::CMs 130420 Specdb::CMs 138154 Specdb::MsMs 96216 Specdb::MsMs 96217 Specdb::MsMs 96218 Specdb::MsMs 160662 Specdb::MsMs 160663 Specdb::MsMs 160664 Specdb::MsMs 2772386 Specdb::MsMs 2772387 Specdb::MsMs 2772388 Specdb::MsMs 2909082 Specdb::MsMs 2909083 Specdb::MsMs 2909084 HMDB37209 #<Reference:0x000055ce3044dc30> powdery sandalwood woody