24813 1 2 3 4 5 17 17 17 15 8 1 2 3 4 4 4 4 5 1 1 1 2 1 5 255 1 2 3 4 5 3.732 2 2.366 2.866 3.366 0.5 -0.5 0.866 0 -0.866 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 53 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 1 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 00000371000020020600000000000000000000000000000000000000000000000000000000000000000000200000000000000000000000000040000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 phosphoryl trichloride IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 phosphoryl trichloride IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 phosphoryl trichloride IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 phosphoryl trichloride IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 phosphoryl trichloride IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 phosphoryl trichloride InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/Cl3OP/c1-5(2,3)4 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 XHXFXVLFKHQFAL-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 1.7 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 151.875235 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 Cl3OP Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 153.33 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 O=P(Cl)(Cl)Cl SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 O=P(Cl)(Cl)Cl Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 17.1 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 151.875235 5 0 0 0 0 0 0 0 1 -1