1.0 2016-06-03 12:16:06 UTC 2026-08-19 08:40:21 UTC methyl 4-[[(2,5-dichlorophenyl)amino]carbonyl]-2-nitrobenzoate SmallMolecule Methyl 4-[[(2,5-dichlorophenyl)amino]carbonyl]-2-nitrobenzoate is an organic compound with the formula C15H10Cl2N2O5 and an average molecular weight of 369.15 g/mol. Methyl 4-[[(2,5-dichlorophenyl)amino]carbonyl]-2-nitrobenzoate belongs to the anilides, a subclass of benzene and substituted derivatives within the organic compounds. This compound is associated with one recorded source, which is drinking water and water supply, specifically drinking water. The recorded route of exposure for this substance is oral. C15H10Cl2N2O5 369.15 367.9966768 N-(2,5-dichlorophenyl)-4-(methoxycarbonyl)-3-nitrobenzene-1-carboximidic acid N-(2,5-dichlorophenyl)-4-(methoxycarbonyl)-3-nitrobenzenecarboximidic acid 83929-47-9 COC(=O)C1=C(C=C(C=C1)C(O)=NC1=C(Cl)C=CC(Cl)=C1)N(=O)=O InChI=1S/C15H10Cl2N2O5/c1-24-15(21)10-4-2-8(6-13(10)19(22)23)14(20)18-12-7-9(16)3-5-11(12)17/h2-7H,1H3,(H,18,20) BVBSCSYCFCDVEU-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Anilides Benzanilides Aryl chlorides Benzamides Benzoic acid esters Benzoyl derivatives Dichlorobenzenes Hydrocarbon derivatives Methyl esters Monocarboxylic acids and derivatives Nitroaromatic compounds Nitrobenzenes Nitrobenzoic acids and derivatives Organic oxides Organic oxoazanium compounds Organic zwitterions Organochlorides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Propargyl-type 1,3-dipolar organic compounds Secondary carboxylic acid amides 1,4-dichlorobenzene Allyl-type 1,3-dipolar organic compound Aromatic homomonocyclic compound Aryl chloride Aryl halide Benzamide Benzanilide Benzoate ester Benzoic acid or derivatives Benzoyl C-nitro compound Carboxamide group Carboxylic acid derivative Carboxylic acid ester Chlorobenzene Halobenzene Hydrocarbon derivative Methyl ester Monocarboxylic acid or derivatives Nitroaromatic compound Nitrobenzene Nitrobenzoate Organic 1,3-dipolar compound Organic nitro compound Organic nitrogen compound Organic oxide Organic oxoazanium Organic oxygen compound Organic zwitterion Organochloride Organohalogen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Propargyl-type 1,3-dipolar organic compound Secondary carboxylic acid amide Aromatic homomonocyclic compounds Detected and Not Quantified logp 3.8 logp 3.81 ALOGPS logs -5.70 ALOGPS solubility 7.42e-04 g/l ALOGPS logp 4.94 ChemAxon pka_strongest_acidic 3.22 ChemAxon pka_strongest_basic -1.3 ChemAxon iupac N-(2,5-dichlorophenyl)-4-(methoxycarbonyl)-3-nitrobenzene-1-carboximidic acid ChemAxon average_mass 369.15 ChemAxon mono_mass 367.9966768 ChemAxon smiles COC(=O)C1=C(C=C(C=C1)C(O)=NC1=C(Cl)C=CC(Cl)=C1)N(=O)=O ChemAxon formula C15H10Cl2N2O5 ChemAxon inchi InChI=1S/C15H10Cl2N2O5/c1-24-15(21)10-4-2-8(6-13(10)19(22)23)14(20)18-12-7-9(16)3-5-11(12)17/h2-7H,1H3,(H,18,20) ChemAxon inchikey BVBSCSYCFCDVEU-UHFFFAOYSA-N ChemAxon polar_surface_area 104.71 ChemAxon refractivity 91.31 ChemAxon polarizability 34.12 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 5 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bcf4c8170> 3019490 2286683