6432145 1 2 3 17 17 6 3 1 1 2 3 3 1 1 1 5 255 1 2 3 3.732 2 2.866 0.25 0.25 -0.25 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2.8 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371000000000600000000000000000000000000000000000000000000000000000000000000020000000000000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/CCl2/c2-1-3 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 PFBUKDPBVNJDEW-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 1.5 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 81.9377054 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 CCl2 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 82.91 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [C](Cl)Cl SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [C](Cl)Cl Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 81.9377054 3 0 0 0 0 0 0 0 1 -1