1.0 2010-04-08 22:11:22 UTC 2019-11-26 03:10:27 UTC FDB014610 (E)-3-(Tetrahydro-5,5-dimethyl-2-furanyl)-2-buten-1-ol Constituent of peppermint oil. (E)-3-(Tetrahydro-5,5-dimethyl-2-furanyl)-2-buten-1-ol is found in herbs and spices. C10H18O2 170.2487 170.13067982 (2Z)-3-(5,5-dimethyloxolan-2-yl)but-2-en-1-ol (2Z)-3-(5,5-dimethyloxolan-2-yl)but-2-en-1-ol 84184-43-0 C\C(=C\CO)C1CCC(C)(C)O1 InChI=1S/C10H18O2/c1-8(5-7-11)9-4-6-10(2,3)12-9/h5,9,11H,4,6-7H2,1-3H3/b8-5- MCCVCDVTCCDPLO-YVMONPNESA-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 Aliphatic heteromonocyclic compounds Dialkyl ethers Hydrocarbon derivatives Oxacyclic compounds Primary alcohols Alcohol Aliphatic heteromonocyclic compound Dialkyl ether Ether Hydrocarbon derivative Organic oxygen compound Organooxygen compound Oxacycle Primary alcohol Tetrahydrofuran logp 1.95 ALOGPS logs -1.55 ALOGPS solubility 4.79e+00 g/l ALOGPS logp 1.37 ChemAxon pka_strongest_acidic 15.62 ChemAxon pka_strongest_basic -2.5 ChemAxon iupac (2Z)-3-(5,5-dimethyloxolan-2-yl)but-2-en-1-ol ChemAxon average_mass 170.2487 ChemAxon mono_mass 170.13067982 ChemAxon smiles C\C(=C\CO)C1CCC(C)(C)O1 ChemAxon formula C10H18O2 ChemAxon inchi InChI=1S/C10H18O2/c1-8(5-7-11)9-4-6-10(2,3)12-9/h5,9,11H,4,6-7H2,1-3H3/b8-5- ChemAxon inchikey MCCVCDVTCCDPLO-YVMONPNESA-N ChemAxon polar_surface_area 29.46 ChemAxon refractivity 50.17 ChemAxon polarizability 20.07 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 7013 Specdb::MsIr 7014 Specdb::MsIr 7015 Specdb::CMs 10145 Specdb::CMs 44593 Specdb::CMs 164725 Specdb::MsMs 105423 Specdb::MsMs 105424 Specdb::MsMs 105425 Specdb::MsMs 171912 Specdb::MsMs 171913 Specdb::MsMs 171914 Specdb::MsMs 2293464 Specdb::MsMs 2293465 Specdb::MsMs 2293466 Specdb::MsMs 2645670 Specdb::MsMs 2645671 Specdb::MsMs 2645672 Specdb::NmrOneD 132778 Specdb::NmrOneD 132779 Specdb::NmrOneD 132780 Specdb::NmrOneD 132781 Specdb::NmrOneD 132782 Specdb::NmrOneD 132783 Specdb::NmrOneD 132784 Specdb::NmrOneD 132785 Specdb::NmrOneD 132786 Specdb::NmrOneD 132787 Specdb::NmrOneD 132788 Specdb::NmrOneD 132789 Specdb::NmrOneD 132790 Specdb::NmrOneD 132791 Specdb::NmrOneD 132792 Specdb::NmrOneD 132793 Specdb::NmrOneD 132794 Specdb::NmrOneD 132795 Specdb::NmrOneD 132796 Specdb::NmrOneD 132797 HMDB35839 #<Reference:0x000055ce31953260> Herbs and Spices Unknown generic