621893 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 15 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 3 4 4 5 6 6 7 7 8 8 9 9 10 10 11 11 12 12 13 13 14 14 15 16 17 17 18 18 19 3 4 5 5 18 6 8 7 9 10 11 20 12 21 13 22 14 23 17 24 15 25 16 26 15 27 16 28 29 30 19 31 19 32 33 1 1 1 1 2 2 1 2 1 2 1 1 1 1 2 1 2 1 1 1 2 1 2 1 1 1 1 1 1 1 2 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 4.5981 5.4641 3.732 5.4641 4.5981 2.866 5.4641 3.732 6.3301 3.732 2 6.3301 2.866 7.1962 2 7.1962 3.732 5.4641 4.5981 2.866 4.9272 4.269 6.3301 3.1951 1.4631 6.3301 2.866 7.7331 1.4631 7.7331 3.1951 6.001 4.5981 -0.5 1 -1 -1 0.5 -0.5 -2 -2 -0.5 1 -1 -2.5 -2.5 -1 -2 -2 2 2 2.5 0.12 -2.31 -2.31 0.12 0.69 -0.69 -3.12 -3.12 -0.69 -2.31 -2.31 2.31 2.31 3.12 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 2 2 3 3 4 4 5 6 7 8 9 10 11 12 13 14 17 18 5 18 6 8 7 9 10 11 12 13 14 17 15 16 15 16 19 19 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 238 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 3 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371C07A00020000000000000000000000000000000000003C608000000000000001D000001C08000000000800C112043C8092081020A0003067440082802031022008D8203864980820E2C09191842008608000C8C8071000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 diphenyl(2-pyridyl)phosphane IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 diphenyl(2-pyridinyl)phosphine IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 diphenyl(pyridin-2-yl)phosphane IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 diphenyl(pyridin-2-yl)phosphane IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 diphenyl(pyridin-2-yl)phosphane IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 diphenyl(2-pyridyl)phosphine InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C17H14NP/c1-3-9-15(10-4-1)19(16-11-5-2-6-12-16)17-13-7-8-14-18-17/h1-14H InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 SVABQOITNJTVNJ-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 3.9 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 263.086386449 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C17H14NP Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 263.27 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=N3 SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=N3 Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 12.9 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 263.086386449 19 0 0 0 0 0 0 0 1 -1