1.0 2010-04-08 22:08:08 UTC 2015-07-20 22:23:33 UTC FDB008551 4-Acetyl-6-tert-butyl-1,1-dimethylindane Flavouring ingredient 1-[6-(1,1-Dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-inden-4-yl]ethanone, 9CI 4-Acetyl-6-butyl-1,1-dimethylindane 4-Acetyl-6-tert-butyl-1,1-dimethyl indan 6-tert-Butyl-1,1-dimethyl-4-indanyl methyl ketone 6-tert-Butyl-1,1-dimethyl-4-indanyl methyl ketone, 8CI 6-tert-Butyl-1,1-dimethylindan-4-yl methyl ketone Celestolide Chrysolide Esperone FEMA 3653 Indane, 4-acetyl-1,1-dimethyl-6-(1,1-dimethylethyl) Ketone, 6-tert-butyl-1,1-dimethyl-4-indanyl methyl Musk celestolide C17H24O 244.3719 244.18271539 1-(6-tert-butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)ethan-1-one 1-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)ethanone 13171-00-1 CC(=O)C1=C2CCC(C)(C)C2=CC(=C1)C(C)(C)C InChI=1S/C17H24O/c1-11(18)14-9-12(16(2,3)4)10-15-13(14)7-8-17(15,5)6/h9-10H,7-8H2,1-6H3 IKTHMQYJOWTSJO-UHFFFAOYSA-N belongs to the class of organic compounds known as indanes. Indanes are compounds containing an indane moiety, which consists of a cyclopentane fused to a benzene ring. Indanes Organic compounds Benzenoids Indanes Aromatic homopolycyclic compounds Acetophenones Aryl alkyl ketones Hydrocarbon derivatives Organic oxides Acetophenone Aromatic homopolycyclic compound Aryl alkyl ketone Aryl ketone Hydrocarbon derivative Indane Ketone Organic oxide Organic oxygen compound Organooxygen compound logp 5.53 ALOGPS logs -5.43 ALOGPS solubility 9.17e-04 g/l ALOGPS melting_point Mp 77.2-77.9° logp 4.67 ChemAxon pka_strongest_acidic 16.18 ChemAxon pka_strongest_basic -7.4 ChemAxon iupac 1-(6-tert-butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)ethan-1-one ChemAxon average_mass 244.3719 ChemAxon mono_mass 244.18271539 ChemAxon smiles CC(=O)C1=C2CCC(C)(C)C2=CC(=C1)C(C)(C)C ChemAxon formula C17H24O ChemAxon inchi InChI=1S/C17H24O/c1-11(18)14-9-12(16(2,3)4)10-15-13(14)7-8-17(15,5)6/h9-10H,7-8H2,1-6H3 ChemAxon inchikey IKTHMQYJOWTSJO-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 77.03 ChemAxon polarizability 29.98 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1232 Specdb::CMs 11195 Specdb::CMs 27961 Specdb::CMs 100982 Specdb::CMs 161473 Specdb::MsMs 106422 Specdb::MsMs 106423 Specdb::MsMs 106424 Specdb::MsMs 173175 Specdb::MsMs 173176 Specdb::MsMs 173177 Specdb::MsMs 2233390 Specdb::MsMs 2254149 Specdb::MsMs 2256290 Specdb::MsMs 2258276 Specdb::MsMs 2258357 Specdb::MsMs 2260237 Specdb::MsMs 2808560 Specdb::MsMs 2808561 Specdb::MsMs 2808562 Specdb::MsMs 2899770 Specdb::MsMs 2899771 Specdb::MsMs 2899772 HMDB31867 #<Reference:0x000055ce332e3b08> ambergris animal cedar musk woody