1.0 2010-04-08 22:07:55 UTC 2020-02-24 19:10:49 UTC FDB008097 4,4'-Diaminodibutylamine Constituent of the famine food Santalum album (sandalwood). Flavouring. 4,4'-Diaminodibutylamine is found in soy bean and cereals and cereal products. 1,4-Butanediamine, N-(4-aminobutyl)- 1,6,11-triazaundecane 1,9-Diamino-5-azanonane bis(4-aminobutyl)amine Homospermidine N-(4-aminobutyl)-1,4-butanediamine N-(4-Aminobutyl)-1,4-butanediamine, 9CI N-(4-aminobutyl)butane-1,4-diamine sym-Homospermidine C8H21N3 159.2724 159.173547687 bis(4-aminobutyl)amine homospermidine 4427-76-3 NCCCCNCCCCN InChI=1S/C8H21N3/c9-5-1-3-7-11-8-4-2-6-10/h11H,1-10H2 UODZHRGDSPLRMD-UHFFFAOYSA-N belongs to the class of organic compounds known as dialkylamines. These are organic compounds containing a dialkylamine group, characterized by two alkyl groups bonded to the amino nitrogen. Dialkylamines Organic compounds Organic nitrogen compounds Organonitrogen compounds Amines Aliphatic acyclic compounds Hydrocarbon derivatives Monoalkylamines Organopnictogen compounds Aliphatic acyclic compound Hydrocarbon derivative Organopnictogen compound Primary aliphatic amine Primary amine Secondary aliphatic amine polyazaalkane triamine logp -0.12 ALOGPS logs -1.10 ALOGPS solubility 1.28e+01 g/l ALOGPS logp -0.63 ChemAxon pka_strongest_basic 10.94 ChemAxon iupac bis(4-aminobutyl)amine ChemAxon average_mass 159.2724 ChemAxon mono_mass 159.173547687 ChemAxon smiles NCCCCNCCCCN ChemAxon formula C8H21N3 ChemAxon inchi InChI=1S/C8H21N3/c9-5-1-3-7-11-8-4-2-6-10/h11H,1-10H2 ChemAxon inchikey UODZHRGDSPLRMD-UHFFFAOYSA-N ChemAxon polar_surface_area 64.07 ChemAxon refractivity 49.61 ChemAxon polarizability 20.65 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 3 ChemAxon donor_count 3 ChemAxon physiological_charge 3 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 14537 Specdb::CMs 160879 Specdb::MsIr 4540 Specdb::MsIr 4541 Specdb::MsIr 4542 Specdb::MsMs 10535 Specdb::MsMs 10536 Specdb::MsMs 10537 Specdb::MsMs 17207 Specdb::MsMs 17208 Specdb::MsMs 17209 Specdb::MsMs 2380245 Specdb::MsMs 2380246 Specdb::MsMs 2380247 Specdb::MsMs 2559333 Specdb::MsMs 2559334 Specdb::MsMs 2559335 Specdb::NmrOneD 164289 Specdb::NmrOneD 164290 Specdb::NmrOneD 164291 Specdb::NmrOneD 164292 Specdb::NmrOneD 164293 Specdb::NmrOneD 164294 Specdb::NmrOneD 164295 Specdb::NmrOneD 164296 Specdb::NmrOneD 164297 Specdb::NmrOneD 164298 Specdb::NmrOneD 164299 Specdb::NmrOneD 164300 Specdb::NmrOneD 164301 Specdb::NmrOneD 164302 Specdb::NmrOneD 164303 Specdb::NmrOneD 164304 Specdb::NmrOneD 164305 Specdb::NmrOneD 164306 Specdb::NmrOneD 164307 Specdb::NmrOneD 164308 HMDB31506 16554 #<Reference:0x000055ce32198c68> Breakfast cereal Type 2 specific Cereals and cereal products Unknown generic Soy bean Type 1 specific Glycine max 3847