1.0 2010-04-08 22:12:03 UTC 2015-07-20 23:22:02 UTC FDB015782 Ambronide Flavouring ingredient 3a,6,6,9a-Tetramethyldodecahydronaphtho[2,1-b]furan 3a,6,6,9a-Tetramethylperhydronaphtho[2,1-b]furan Amberlyn Ambronide Ambrox Ambroxan Bicyclofarnesyl epoxide FEMA 3471 n-Epoxide C16H28O 236.3929 236.214015518 3a,6,6,9a-tetramethyl-dodecahydronaphtho[2,1-b]furan ambroxan 6790-58-5 CC12CCC3C(C)(C)CCCC3(C)C1CCO2 InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3 YPZUZOLGGMJZJO-UHFFFAOYSA-N belongs to the class of organic compounds known as naphthofurans. Naphthofurans are compounds containing a furan ring fused to a naphthalene moiety. Furan is a 5 membered- ring aromatic ring with four carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings. Naphthofurans Organic compounds Organoheterocyclic compounds Naphthofurans Aliphatic heteropolycyclic compounds Dialkyl ethers Hydrocarbon derivatives Oxacyclic compounds Tetrahydrofurans Aliphatic heteropolycyclic compound Dialkyl ether Ether Hydrocarbon derivative Naphthofuran Organic oxygen compound Organooxygen compound Oxacycle Tetrahydrofuran logp 4.25 ALOGPS logs -5.83 ALOGPS solubility 3.52e-04 g/l ALOGPS melting_point Mp 75-76° logp 3.98 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac 3a,6,6,9a-tetramethyl-dodecahydronaphtho[2,1-b]furan ChemAxon average_mass 236.3929 ChemAxon mono_mass 236.214015518 ChemAxon smiles CC12CCC3C(C)(C)CCCC3(C)C1CCO2 ChemAxon formula C16H28O ChemAxon inchi InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3 ChemAxon inchikey YPZUZOLGGMJZJO-UHFFFAOYSA-N ChemAxon polar_surface_area 9.23 ChemAxon refractivity 71.4 ChemAxon polarizability 29.02 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22978 Specdb::CMs 150318 Specdb::MsMs 12347 Specdb::MsMs 12348 Specdb::MsMs 12349 Specdb::MsMs 19019 Specdb::MsMs 19020 Specdb::MsMs 19021 Specdb::MsMs 2347418 Specdb::MsMs 2347419 Specdb::MsMs 2347420 Specdb::MsMs 2592097 Specdb::MsMs 2592098 Specdb::MsMs 2592099 HMDB36831 #<Reference:0x00005612716bac68> ambergris dry labdanum old paper sweet