1.0 2010-04-08 22:12:10 UTC 2019-11-26 03:12:34 UTC FDB015999 6,8-Epoxy-p-menthane Minor constituent of caraway oil. 6,8-Epoxy-p-menthane is found in caraway, fats and oils, and herbs and spices. 2',3'-DIDEOXYCYTIDINE 2',3'-DIDEOXYCYTIDINE (DDC) 2',3'-Dideoxycytidine-2',3'-3H 4,7,7-Trimethyl-6-oxabicyclo[3.2.1]octane Dideoxycytidine-3H Dihydropinol Zalcitabine C10H18O 154.2493 154.135765198 4,7,7-trimethyl-6-oxabicyclo[3.2.1]octane 4,7,7-trimethyl-6-oxabicyclo[3.2.1]octane 5718-77-4 CC1CCC2CC1OC2(C)C InChI=1S/C10H18O/c1-7-4-5-8-6-9(7)11-10(8,2)3/h7-9H,4-6H2,1-3H3 MGRKVRJGCZXQGW-UHFFFAOYSA-N belongs to the class of organic compounds known as oxepanes. Oxepanes are compounds containing an oxepane ring, which is a seven-member saturated aliphatic heterocycle with one oxygen and six carbon atoms. Oxepanes Organic compounds Organoheterocyclic compounds Oxepanes Aliphatic heteropolycyclic compounds Dialkyl ethers Hydrocarbon derivatives Oxacyclic compounds Tetrahydrofurans Aliphatic heteropolycyclic compound Dialkyl ether Ether Hydrocarbon derivative Organic oxygen compound Organooxygen compound Oxacycle Oxepane Tetrahydrofuran logp 2.59 ALOGPS logs -3.56 ALOGPS solubility 4.27e-02 g/l ALOGPS logp 2.43 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac 4,7,7-trimethyl-6-oxabicyclo[3.2.1]octane ChemAxon average_mass 154.2493 ChemAxon mono_mass 154.135765198 ChemAxon smiles CC1CCC2CC1OC2(C)C ChemAxon formula C10H18O ChemAxon inchi InChI=1S/C10H18O/c1-7-4-5-8-6-9(7)11-10(8,2)3/h7-9H,4-6H2,1-3H3 ChemAxon inchikey MGRKVRJGCZXQGW-UHFFFAOYSA-N ChemAxon polar_surface_area 9.23 ChemAxon refractivity 45.69 ChemAxon polarizability 18.52 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 19940 Specdb::CMs 132991 Specdb::CMs 140725 Specdb::MsMs 8156 Specdb::MsMs 8157 Specdb::MsMs 8158 Specdb::MsMs 14828 Specdb::MsMs 14829 Specdb::MsMs 14830 Specdb::MsMs 2680395 Specdb::MsMs 2680396 Specdb::MsMs 2680397 Specdb::MsMs 3025506 Specdb::MsMs 3025507 Specdb::MsMs 3025508 HMDB37019 #<Reference:0x000055ce32cac960> Caraway Type 1 specific Carum carvi 48032 Fats and oils Unknown generic Herbs and Spices Unknown generic