1.0 2010-04-08 22:10:46 UTC 2025-11-18 23:45:50 UTC FDB013532 alpha-Santal-10-en-12-ol A coml. mixture of a-santalol and <ht>KFQ12-T</ht> obtained by fractional distillation of sandalwood oil is used as a flavouring ingredient, *FEMA 3006*. alpha-Santal-10-en-12-ol is found in wild celery. 5-(2,3-Dimethyltricyclo[2.2.1.02,6]hept-3-yl)-2-methyl-2-penten-1-ol, 9CI a-Santalol C15H24O 220.3505 220.18271539 (2Z)-5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methylpent-2-en-1-ol Α-santalol C\C(CO)=C\CCC1(C)C2CC3C(C2)C13C InChI=1S/C15H24O/c1-10(9-16)5-4-6-14(2)11-7-12-13(8-11)15(12,14)3/h5,11-13,16H,4,6-9H2,1-3H3/b10-5- PDEQKAVEYSOLJX-YHYXMXQVSA-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 Fatty alcohols Hydrocarbon derivatives Primary alcohols Alcohol Aliphatic homopolycyclic compound Fatty acyl Fatty alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Primary alcohol Santalane sesquiterpenoid Sesquiterpenoid logp 3.93 ALOGPS logs -4.15 ALOGPS solubility 1.54e-02 g/l ALOGPS logp 2.82 ChemAxon pka_strongest_acidic 16.64 ChemAxon pka_strongest_basic -2.1 ChemAxon iupac (2Z)-5-{2,3-dimethyltricyclo[2.2.1.0²,⁶]heptan-3-yl}-2-methylpent-2-en-1-ol ChemAxon average_mass 220.3505 ChemAxon mono_mass 220.18271539 ChemAxon smiles C\C(CO)=C\CCC1(C)C2CC3C(C2)C13C ChemAxon formula C15H24O ChemAxon inchi InChI=1S/C15H24O/c1-10(9-16)5-4-6-14(2)11-7-12-13(8-11)15(12,14)3/h5,11-13,16H,4,6-9H2,1-3H3/b10-5- ChemAxon inchikey PDEQKAVEYSOLJX-YHYXMXQVSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 67.47 ChemAxon polarizability 27.19 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21374 Specdb::CMs 44099 Specdb::CMs 156215 Specdb::MsMs 63642 Specdb::MsMs 63643 Specdb::MsMs 63644 Specdb::MsMs 120612 Specdb::MsMs 120613 Specdb::MsMs 120614 Specdb::MsMs 2828627 Specdb::MsMs 2828628 Specdb::MsMs 2828629 Specdb::MsMs 2853019 Specdb::MsMs 2853020 Specdb::MsMs 2853021 HMDB0034940 Wild celery Type 1 specific Apium graveolens 4045 Name 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.