10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)

C169H164F6Ir3N14O10PdPt3Rh3-10 — CID 162148681

About 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)

10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium) (PubChem CID 162148681) has the molecular formula C169H164F6Ir3N14O10PdPt3Rh3-10 and a molecular weight of 4242.27 g/mol. Its IUPAC name is 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium).

Molecular Properties

• Compound Name: 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)
• PubChem CID: 162148681
• Molecular Formula: C169H164F6Ir3N14O10PdPt3Rh3-10
• Molecular Weight: 4242.27 g/mol
• Exact Mass: 4241.67
• IUPAC Name: 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)
• SMILES: CC(O)CC(C)O.CC(O)CC(C)O.CC(O)CC(C)O.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cc1[c-]c(-c2ccccn2)cc(C)c1.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C(O)c1[c-]cccc1.O=C(O)c1ccccn1.[Ir].[Ir].[Ir].[Pd].[Pt+2].[Pt].[Pt].[Rh].[Rh].[Rh].[c-]1cccc2ccc3cccnc3c12.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1Cc1ccccn1
• InChI: InChI=1S/C36H44N4.C13H8N.C13H12N.C12H6F4N.C12H10N.C11H6F2N.4C11H8N.C7H5O2.C6H5NO2.3C5H12O2.3Ir.Pd.3Pt.3Rh/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;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;1-10-7-11(2)9-12(8-10)13-5-3-4-6-14-13;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;1-2-6-11(7-3-1)10-12-8-4-5-9-13-12;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;8-7(9)6-4-2-1-3-5-6;8-6(9)5-3-1-2-4-7-5;3*1-4(6)3-5(2)7;;;;;;;;;;/h17-20H,9-16H2,1-8H3;1-5,7-9H;3-8H,1-2H3;1,3-7H;1-6,8-9H,10H2;1-4,6-7H;4*1-6,8-9H;2*1-4H,(H,8,9);3*4-7H,3H2,1-2H3;;;;;;;;;;/q-2;10*-1;;;;;;;;;;;+2;;;/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-
• InChIKey: WWSKKWHQGOQHRZ-KHGPSUTCSA-N
• XLogP: 37.19
• TPSA: 378.86 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 20
• Rotatable Bonds: 25
• Heavy Atoms: 209
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4242.27
LogP ≤ 5	37.19
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)?

The IUPAC name of 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium) (CID 162148681) is 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium).

What is the SMILES notation for 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)?

The canonical SMILES for 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium) is CC(O)CC(C)O.CC(O)CC(C)O.CC(O)CC(C)O.CCC1=C(CC)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CC)c5CC)C(CC)=C4CC)c(CC)c3CC.Cc1[c-]c(-c2ccccn2)cc(C)c1.Fc1c[c-]c(-c2ccc(C(F)(F)F)cn2)cc1.Fc1c[c-]c(-c2ccccn2)c(F)c1.O=C(O)c1[c-]cccc1.O=C(O)c1ccccn1.[Ir].[Ir].[Ir].[Pd].[Pt+2].[Pt].[Pt].[Rh].[Rh].[Rh].[c-]1cccc2ccc3cccnc3c12.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1Cc1ccccn1.

What is the InChIKey of 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)?

The InChIKey is WWSKKWHQGOQHRZ-KHGPSUTCSA-N. The full InChI is InChI=1S/C36H44N4.C13H8N.C13H12N.C12H6F4N.C12H10N.C11H6F2N.4C11H8N.C7H5O2.C6H5NO2.3C5H12O2.3Ir.Pd.3Pt.3Rh/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;1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;1-10-7-11(2)9-12(8-10)13-5-3-4-6-14-13;13-10-4-1-8(2-5-10)11-6-3-9(7-17-11)12(14,15)16;1-2-6-11(7-3-1)10-12-8-4-5-9-13-12;12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;4*1-2-6-10(7-3-1)11-8-4-5-9-12-11;8-7(9)6-4-2-1-3-5-6;8-6(9)5-3-1-2-4-7-5;3*1-4(6)3-5(2)7;;;;;;;;;;/h17-20H,9-16H2,1-8H3;1-5,7-9H;3-8H,1-2H3;1,3-7H;1-6,8-9H,10H2;1-4,6-7H;4*1-6,8-9H;2*1-4H,(H,8,9);3*4-7H,3H2,1-2H3;;;;;;;;;;/q-2;10*-1;;;;;;;;;;;+2;;;/b29-17-,30-18-,31-17-,32-18-,33-19-,34-20-,35-19-,36-20-;;;;;;;;;;;;;;;;;;;;;;;;.

What are the key properties of 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium)?

10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium) has a molecular weight of 4242.27 g/mol, XLogP of 37.19, 25 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 10H-benzo[h]quinolin-10-ide;benzoic acid;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(3,5-dimethylbenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-5-(trifluoromethyl)pyridine;tris(iridium);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide;palladium;tris(pentane-2,4-diol);2-(phenylmethyl)pyridine;tetrakis(2-phenylpyridine);platinum;platinum(2+);pyridine-2-carboxylic acid;tris(rhodium) is sourced from PubChem (CID 162148681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).