76939 1 2 3 4 17 17 7 1 1 2 3 3 3 4 1 1 1 1 5 255 1 2 3 4 3.732 2 2.866 2.866 0.56 0.56 0.06 -0.56 0 Compound Canonicalized 5 2010.01.29 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 2.8 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371000200000600000000000000000000000000000000000000000000000000000000000000001020000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 dichloroamine InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/Cl2HN/c1-3-2/h3H InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 JSYGRUBHOCKMGQ-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2019.06.18 1.4 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 84.9486044 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 Cl2HN Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 85.92 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 N(Cl)Cl SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 N(Cl)Cl Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 12 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 84.9486044 3 0 0 0 0 0 0 0 1 -1