1.0 2016-06-03 13:11:01 UTC 2026-08-22 20:43:26 UTC 3-chloropropyldimethylammonium SmallMolecule 3-chloropropyldimethylammonium is an organic nitrogen compound with the formula C5H12ClN and an average molecular weight of 121.61 g/mol. 3-chloropropyldimethylammonium belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. This substance has been found in or released from one recorded source: drinking water and water supply (drinking water). The recorded exposure route for this compound is oral. C5H12ClN 121.61 121.0658271 (3-chloropropyl)dimethylamine (3-chloropropyl)dimethylamine 109-54-6 CN(C)CCCCl InChI=1S/C5H12ClN/c1-7(2)5-3-4-6/h3-5H2,1-2H3 NYYRRBOMNHUCLB-UHFFFAOYSA-N Organic compounds Organic nitrogen compounds Organonitrogen compounds Amines Trialkylamines Alkyl chlorides Hydrocarbon derivatives Organochlorides Organopnictogen compounds Aliphatic acyclic compound Alkyl chloride Alkyl halide Hydrocarbon derivative Organochloride Organohalogen compound Organopnictogen compound Tertiary aliphatic amine Aliphatic acyclic compounds Detected and Not Quantified logp 1.2 logp 1.06 ALOGPS logs 0.03 ALOGPS solubility 1.31e+02 g/l ALOGPS logp 0.91 ChemAxon pka_strongest_basic 8.68 ChemAxon iupac (3-chloropropyl)dimethylamine ChemAxon average_mass 121.61 ChemAxon mono_mass 121.0658271 ChemAxon smiles CN(C)CCCCl ChemAxon formula C5H12ClN ChemAxon inchi InChI=1S/C5H12ClN/c1-7(2)5-3-4-6/h3-5H2,1-2H3 ChemAxon inchikey NYYRRBOMNHUCLB-UHFFFAOYSA-N ChemAxon polar_surface_area 3.24 ChemAxon refractivity 34.2 ChemAxon polarizability 13.72 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7267c464a0> 66960 60319