1.0 2010-04-08 22:13:55 UTC 2019-11-26 03:16:38 UTC FDB018761 (3-Aminopropoxy)guanidine Constituent of Canavalia gladiata (swordbean). (3-Aminopropoxy)guanidine is found in pulses. g-Guanidinooxypropylamine Guanidinooxypropylamine C4H12N4O 132.1643 132.101111026 1-(3-aminopropoxy)guanidine 1-(3-aminopropoxy)guanidine 97091-01-5 NCCCONC(N)=N InChI=1S/C4H12N4O/c5-2-1-3-9-8-4(6)7/h1-3,5H2,(H4,6,7,8) JGMONYLSKFKAJN-UHFFFAOYSA-N belongs to the class of organic compounds known as guanidines. Guanidines are compounds containing a guanidine moiety, with the general structure (R1R2N)(R3R4N)C=N-R5. Guanidines Organic compounds Organic nitrogen compounds Organonitrogen compounds Guanidines Aliphatic acyclic compounds Hydrocarbon derivatives Monoalkylamines Organooxygen compounds Organopnictogen compounds Aliphatic acyclic compound Amine Guanidine Hydrocarbon derivative Organic oxygen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine logp -1.52 ALOGPS logs -1.57 ALOGPS solubility 3.57e+00 g/l ALOGPS logp -1.5 ChemAxon pka_strongest_basic 10.57 ChemAxon iupac 1-(3-aminopropoxy)guanidine ChemAxon average_mass 132.1643 ChemAxon mono_mass 132.101111026 ChemAxon smiles NCCCONC(N)=N ChemAxon formula C4H12N4O ChemAxon inchi InChI=1S/C4H12N4O/c5-2-1-3-9-8-4(6)7/h1-3,5H2,(H4,6,7,8) ChemAxon inchikey JGMONYLSKFKAJN-UHFFFAOYSA-N ChemAxon polar_surface_area 97.15 ChemAxon refractivity 55.41 ChemAxon polarizability 14.12 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 5 ChemAxon donor_count 4 ChemAxon physiological_charge 2 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 8133 Specdb::MsIr 8134 Specdb::MsIr 8135 Specdb::NmrOneD 31662 Specdb::NmrOneD 31663 Specdb::NmrOneD 31664 Specdb::NmrOneD 31665 Specdb::NmrOneD 31666 Specdb::NmrOneD 31667 Specdb::NmrOneD 31668 Specdb::NmrOneD 31669 Specdb::NmrOneD 31670 Specdb::NmrOneD 31671 Specdb::NmrOneD 31672 Specdb::NmrOneD 31673 Specdb::NmrOneD 31674 Specdb::NmrOneD 31675 Specdb::NmrOneD 31676 Specdb::NmrOneD 31677 Specdb::NmrOneD 31678 Specdb::NmrOneD 31679 Specdb::NmrOneD 31680 Specdb::NmrOneD 31681 Specdb::CMs 10327 Specdb::CMs 162881 Specdb::MsMs 10346 Specdb::MsMs 10347 Specdb::MsMs 10348 Specdb::MsMs 17018 Specdb::MsMs 17019 Specdb::MsMs 17020 Specdb::MsMs 2832123 Specdb::MsMs 2832124 Specdb::MsMs 2832125 Specdb::MsMs 2849881 Specdb::MsMs 2849882 Specdb::MsMs 2849883 HMDB39228 #<Reference:0x000055ce31a4c4c8> Pulses Unknown generic