1.0 2010-04-08 22:14:58 UTC 2019-11-26 03:18:49 UTC FDB020362 Dihydro-2-methyl-3(2H)-furanthione Component of roasted meat aroma. Food flavouring agent. Dihydro-2-methyl-3(2H)-furanthione is found in animal foods. 4,5-Dihydro-2-methyl-3-furanthiol, 9CI 4,5-Dihydro-3-mercapto-2-methylfuran C5H8OS 116.181 116.029585568 2-methyl-4,5-dihydrofuran-3-thiol 2-methyl-4,5-dihydrofuran-3-thiol 65936-86-9 CC1=C(S)CCO1 InChI=1S/C5H8OS/c1-4-5(7)2-3-6-4/h7H,2-3H2,1H3 IHRSRTFITLMUQC-UHFFFAOYSA-N belongs to the class of organic compounds known as dihydrofurans. Dihydrofurans are compounds containing a dihydrofuran moiety, which is a furan derivative with only one double bond. Dihydrofurans Organic compounds Organoheterocyclic compounds Dihydrofurans Aliphatic heteromonocyclic compounds Alkylthiols Hydrocarbon derivatives Organooxygen compounds Oxacyclic compounds Thioenols Aliphatic heteromonocyclic compound Alkylthiol Dihydrofuran Hydrocarbon derivative Organic oxygen compound Organooxygen compound Organosulfur compound Oxacycle Thioenol logp 1.41 ALOGPS logs -1.10 ALOGPS solubility 9.25e+00 g/l ALOGPS logp 0.23 ChemAxon pka_strongest_acidic 7.84 ChemAxon pka_strongest_basic -4.8 ChemAxon iupac 2-methyl-4,5-dihydrofuran-3-thiol ChemAxon average_mass 116.181 ChemAxon mono_mass 116.029585568 ChemAxon smiles CC1=C(S)CCO1 ChemAxon formula C5H8OS ChemAxon inchi InChI=1S/C5H8OS/c1-4-5(7)2-3-6-4/h7H,2-3H2,1H3 ChemAxon inchikey IHRSRTFITLMUQC-UHFFFAOYSA-N ChemAxon polar_surface_area 9.23 ChemAxon refractivity 34.6 ChemAxon polarizability 12.33 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 9014 Specdb::MsIr 9015 Specdb::MsIr 9016 Specdb::CMs 12655 Specdb::CMs 161053 Specdb::MsMs 46494 Specdb::MsMs 46495 Specdb::MsMs 46496 Specdb::MsMs 117099 Specdb::MsMs 117100 Specdb::MsMs 117101 Specdb::MsMs 2792609 Specdb::MsMs 2792610 Specdb::MsMs 2792611 Specdb::MsMs 2916191 Specdb::MsMs 2916192 Specdb::MsMs 2916193 Specdb::NmrOneD 42082 Specdb::NmrOneD 42083 Specdb::NmrOneD 42084 Specdb::NmrOneD 42085 Specdb::NmrOneD 42086 Specdb::NmrOneD 42087 Specdb::NmrOneD 42088 Specdb::NmrOneD 42089 Specdb::NmrOneD 42090 Specdb::NmrOneD 42091 Specdb::NmrOneD 42092 Specdb::NmrOneD 42093 Specdb::NmrOneD 42094 Specdb::NmrOneD 42095 Specdb::NmrOneD 42096 Specdb::NmrOneD 42097 Specdb::NmrOneD 42098 Specdb::NmrOneD 42099 Specdb::NmrOneD 42100 Specdb::NmrOneD 42101 HMDB40580 #<Reference:0x000055ce319ff510>