1.0 2010-04-08 22:14:12 UTC 2015-07-21 06:34:06 UTC FDB019209 5-Imino-2-methyl-1-cyclopenten-1-ol Maillard product, formed in roast meat aroma model systems 2-Hydroxy-3-methyl-2-cyclopentenimine C6H9NO 111.1418 111.068413915 5-imino-2-methylcyclopent-1-en-1-ol 5-imino-2-methylcyclopent-1-en-1-ol 61133-60-6 CC1=C(O)C(=N)CC1 InChI=1S/C6H9NO/c1-4-2-3-5(7)6(4)8/h7-8H,2-3H2,1H3 FUWRNKPZYXVMOZ-UHFFFAOYSA-N belongs to the class of organic compounds known as ketimines. These are organic compounds bearing the ketimine functional group, with the general structure R2C=NR' ( R is not a hydrogen ). Ketimines Organic compounds Organic nitrogen compounds Organonitrogen compounds Imines Aliphatic homomonocyclic compounds Carbonyl compounds Enols Hydrocarbon derivatives Organopnictogen compounds Aliphatic homomonocyclic compound Carbonyl group Enol Hydrocarbon derivative Ketimine Organic oxygen compound Organooxygen compound Organopnictogen compound logp 0.35 ALOGPS logs -1.77 ALOGPS solubility 1.88e+00 g/l ALOGPS melting_point Mp 95.2-96.2° logp 0.78 ChemAxon pka_strongest_acidic 9.51 ChemAxon pka_strongest_basic 7.35 ChemAxon iupac 5-imino-2-methylcyclopent-1-en-1-ol ChemAxon average_mass 111.1418 ChemAxon mono_mass 111.068413915 ChemAxon smiles CC1=C(O)C(=N)CC1 ChemAxon formula C6H9NO ChemAxon inchi InChI=1S/C6H9NO/c1-4-2-3-5(7)6(4)8/h7-8H,2-3H2,1H3 ChemAxon inchikey FUWRNKPZYXVMOZ-UHFFFAOYSA-N ChemAxon polar_surface_area 44.08 ChemAxon refractivity 43.46 ChemAxon polarizability 12.07 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 8197 Specdb::MsIr 8198 Specdb::MsIr 8199 Specdb::CMs 13178 Specdb::CMs 46469 Specdb::CMs 136847 Specdb::CMs 144581 Specdb::NmrOneD 33942 Specdb::NmrOneD 33943 Specdb::NmrOneD 33944 Specdb::NmrOneD 33945 Specdb::NmrOneD 33946 Specdb::NmrOneD 33947 Specdb::NmrOneD 33948 Specdb::NmrOneD 33949 Specdb::NmrOneD 33950 Specdb::NmrOneD 33951 Specdb::NmrOneD 33952 Specdb::NmrOneD 33953 Specdb::NmrOneD 33954 Specdb::NmrOneD 33955 Specdb::NmrOneD 33956 Specdb::NmrOneD 33957 Specdb::NmrOneD 33958 Specdb::NmrOneD 33959 Specdb::NmrOneD 33960 Specdb::NmrOneD 33961 Specdb::MsMs 100722 Specdb::MsMs 100723 Specdb::MsMs 100724 Specdb::MsMs 166152 Specdb::MsMs 166153 Specdb::MsMs 166154 Specdb::MsMs 2363786 Specdb::MsMs 2363787 Specdb::MsMs 2363788 Specdb::MsMs 2601725 Specdb::MsMs 2601726 Specdb::MsMs 2601727 HMDB39584 #<Reference:0x000055ce3250dfd8>