1.0 2010-04-08 22:14:46 UTC 2019-11-26 03:18:24 UTC FDB020056 xi-2,5-Dihydro-2,4-dimethylthiazole Volatile component of roasted peanuts and fried chicken. xi-2,5-Dihydro-2,4-dimethylthiazole is found in animal foods and nuts. C5H9NS 115.197 115.045569983 2,4-dimethyl-2,5-dihydro-1,3-thiazole 2,4-dimethyl-2,5-dihydro-1,3-thiazole CC1SCC(C)=N1 InChI=1S/C5H9NS/c1-4-3-7-5(2)6-4/h5H,3H2,1-2H3 PLOCKLWJINZHTI-UHFFFAOYSA-N belongs to the class of organic compounds known as thiazolines. These are heterocyclic compounds containing a five-member unsaturated aliphatic ring with one nitrogen atom, one sulfur atom, three carbon atoms. Thiazolines Organic compounds Organoheterocyclic compounds Azolines Thiazolines Aliphatic heteromonocyclic compounds Azacyclic compounds Dialkylthioethers Hydrocarbon derivatives Ketimines Organopnictogen compounds Propargyl-type 1,3-dipolar organic compounds Aliphatic heteromonocyclic compound Azacycle Dialkylthioether Hydrocarbon derivative Imine Ketimine Meta-thiazoline Organic 1,3-dipolar compound Organic nitrogen compound Organonitrogen compound Organopnictogen compound Propargyl-type 1,3-dipolar organic compound Thioether logp 1.38 ALOGPS logs -1.49 ALOGPS solubility 3.72e+00 g/l ALOGPS logp 0.74 ChemAxon pka_strongest_basic 5.32 ChemAxon iupac 2,4-dimethyl-2,5-dihydro-1,3-thiazole ChemAxon average_mass 115.197 ChemAxon mono_mass 115.045569983 ChemAxon smiles CC1SCC(C)=N1 ChemAxon formula C5H9NS ChemAxon inchi InChI=1S/C5H9NS/c1-4-3-7-5(2)6-4/h5H,3H2,1-2H3 ChemAxon inchikey PLOCKLWJINZHTI-UHFFFAOYSA-N ChemAxon polar_surface_area 12.36 ChemAxon refractivity 33.55 ChemAxon polarizability 12.8 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10803 Specdb::CMs 149355 Specdb::MsIr 8911 Specdb::MsIr 8912 Specdb::MsMs 289786 Specdb::MsMs 289787 Specdb::MsMs 289788 Specdb::MsMs 329323 Specdb::MsMs 329324 Specdb::MsMs 329325 Specdb::MsMs 2673107 Specdb::MsMs 2673108 Specdb::MsMs 2673109 Specdb::MsMs 3032948 Specdb::MsMs 3032949 Specdb::MsMs 3032950 Specdb::NmrOneD 39822 Specdb::NmrOneD 39823 Specdb::NmrOneD 39824 Specdb::NmrOneD 39825 Specdb::NmrOneD 39826 Specdb::NmrOneD 39827 Specdb::NmrOneD 39828 Specdb::NmrOneD 39829 Specdb::NmrOneD 39830 Specdb::NmrOneD 39831 Specdb::NmrOneD 39832 Specdb::NmrOneD 39833 Specdb::NmrOneD 39834 Specdb::NmrOneD 39835 Specdb::NmrOneD 39836 Specdb::NmrOneD 39837 Specdb::NmrOneD 39838 Specdb::NmrOneD 39839 Specdb::NmrOneD 39840 Specdb::NmrOneD 39841 HMDB40331 #<Reference:0x000055ce2eab9f58> Nuts Unknown generic