2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)

C127H104F20IrN8O4OsP2Pt3-3 — CID 158220777

IUPAC2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)
SMILESC(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Os+].[Pt+2].[Pt].[Pt].[c-]1ccc(-c2ccccc2)cc1-c1cc(-c2ccccc2)ccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C36H44N4.C26H22P2.C23H16N.C12H6F4N.C11H6F2N.C11H8N.2C4HF7O2.Ir.Os.3Pt/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-8-18(9-4-1)20-12-7-13-22(16-20)23-17-21(14-15-24-23)19-10-5-2-6-11-19;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-12,14-17H;1,3-7H;1-4,6-7H;1-6,8-9H;2*(H,12,13);;;;;/q-2;;4*-1;;;;+1;;;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;
InChIKeyNXOGYQKPJYFJKD-WSZPVVFGSA-N
MW3215.87 g/mol
LogP30.56
Rot. Bonds24

About 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)

2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+) (PubChem CID 158220777) has the molecular formula C127H104F20IrN8O4OsP2Pt3-3 and a molecular weight of 3215.87 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+).

Molecular Properties

Compound Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)
PubChem CID158220777
Molecular FormulaC127H104F20IrN8O4OsP2Pt3-3
Molecular Weight3215.87 g/mol
Exact Mass3216.55
IUPAC Name2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)
SMILESC(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Os+].[Pt+2].[Pt].[Pt].[c-]1ccc(-c2ccccc2)cc1-c1cc(-c2ccccc2)ccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C36H44N4.C26H22P2.C23H16N.C12H6F4N.C11H6F2N.C11H8N.2C4HF7O2.Ir.Os.3Pt/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-8-18(9-4-1)20-12-7-13-22(16-20)23-17-21(14-15-24-23)19-10-5-2-6-11-19;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-12,14-17H;1,3-7H;1-4,6-7H;1-6,8-9H;2*(H,12,13);;;;;/q-2;;4*-1;;;;+1;;;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;
InChIKeyNXOGYQKPJYFJKD-WSZPVVFGSA-N
XLogP30.56
TPSA185.80 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds24
Heavy Atoms166
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003215.87
LogP ≤ 530.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+) (CID 158220777) is 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+).
What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+) is C(=C[PH+](c1ccccc1)c1ccccc1)[PH+](c1ccccc1)c1ccccc1.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.O=C([O-])C(F)(F)C(F)(F)C(F)(F)F.[Ir].[Os+].[Pt+2].[Pt].[Pt].[c-]1ccc(-c2ccccc2)cc1-c1cc(-c2ccccc2)ccn1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
The InChIKey is NXOGYQKPJYFJKD-WSZPVVFGSA-N. The full InChI is InChI=1S/C36H44N4.C26H22P2.C23H16N.C12H6F4N.C11H6F2N.C11H8N.2C4HF7O2.Ir.Os.3Pt/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-8-18(9-4-1)20-12-7-13-22(16-20)23-17-21(14-15-24-23)19-10-5-2-6-11-19;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;2*5-2(6,1(12)13)3(7,8)4(9,10)11;;;;;/h17-20H,9-16H2,1-8H3;1-22H;1-12,14-17H;1,3-7H;1-4,6-7H;1-6,8-9H;2*(H,12,13);;;;;/q-2;;4*-1;;;;+1;;;+2/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;.
What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+)?
2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+) has a molecular weight of 3215.87 g/mol, XLogP of 30.56, 24 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-diphenylphosphaniumylethenyl(diphenyl)phosphanium;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;bis(2,2,3,3,4,4,4-heptafluorobutanoate);iridium;2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;osmium(1+);4-phenyl-2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenylpyridine;platinum;platinum(2+) is sourced from PubChem (CID 158220777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).