1.0 2010-04-08 22:04:57 UTC 2019-11-26 02:56:27 UTC FDB001411 (+)-Bottrospicatol [(1S,5S,7R)-3,7-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-7-yl]methanol is a member of the class of compounds known as tetrahydrofurans. Tetrahydrofurans are heterocyclic compounds containing a saturated, aliphatic, five-membered ring where a carbon is replaced by an oxygen. [(1S,5S,7R)-3,7-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-7-yl]methanol is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). C10H16O2 168.2328 168.115029756 [(1S,5S,7R)-3,7-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-7-yl]methanol [(1S,5S,7R)-3,7-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-7-yl]methanol 84453-40-7 CC1=C[C@@H]2C[C@@H](C1)O[C@@]2(C)CO InChI=1S/C10H16O2/c1-7-3-8-5-9(4-7)12-10(8,2)6-11/h3,8-9,11H,4-6H2,1-2H3/t8?,9-,10+/m1/s1 OMWUOSNAHMXNQJ-XVBQNVSMSA-N belongs to the class of organic compounds known as tetrahydrofurans. These are heterocyclic compounds containing a saturated, aliphatic, five-membered ring where a carbon is replaced by an oxygen. Tetrahydrofurans Organic compounds Organoheterocyclic compounds Tetrahydrofurans logp 0.94 ALOGPS logs -1.35 ALOGPS solubility 7.49e+00 g/l ALOGPS logp 0.9 ChemAxon pka_strongest_acidic 14.36 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac [(1S,5S,7R)-3,7-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-7-yl]methanol ChemAxon average_mass 168.2328 ChemAxon mono_mass 168.115029756 ChemAxon smiles CC1=C[C@@H]2C[C@@H](C1)O[C@@]2(C)CO ChemAxon formula C10H16O2 ChemAxon inchi InChI=1S/C10H16O2/c1-7-3-8-5-9(4-7)12-10(8,2)6-11/h3,8-9,11H,4-6H2,1-2H3/t8?,9-,10+/m1/s1 ChemAxon inchikey OMWUOSNAHMXNQJ-XVBQNVSMSA-N ChemAxon polar_surface_area 29.46 ChemAxon refractivity 48.16 ChemAxon polarizability 25.93 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 1298395 Specdb::MsMs 1298396 Specdb::MsMs 1298397 Specdb::MsMs 1413010 Specdb::MsMs 1413011 Specdb::MsMs 1413012 Spearmint Type 1 specific Mentha spicata 29719