2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum

C79H86N3OPt- — CID 177264732

About 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum

2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum (PubChem CID 177264732) has the molecular formula C79H86N3OPt- and a molecular weight of 1288.65 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum.

Molecular Properties

• Compound Name: 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum
• PubChem CID: 177264732
• Molecular Formula: C79H86N3OPt-
• Molecular Weight: 1288.65 g/mol
• Exact Mass: 1287.64
• IUPAC Name: 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum
• SMILES: Cc1cc(-c2ccccc2)cc(C)c1-c1cc(-c2[c-]c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccc5c6c(cccc46)C(C)(C)CC5(C)C)cc3C(C)C)cc(C(C)(C)C)c2)nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c1.[Pt]
• InChI: InChI=1S/C79H86N3O.Pt/c1-46(2)60-39-52(58-32-33-64-71-59(58)28-25-29-63(71)78(16,17)45-79(64,18)19)40-61(47(3)4)72(60)82-69-31-24-23-30-66(69)81-74(82)55-36-53(37-56(38-55)75(7,8)9)67-41-54(70-48(5)34-51(35-49(70)6)50-26-21-20-22-27-50)42-68(80-67)62-43-57(76(10,11)12)44-65(73(62)83)77(13,14)15;/h20-35,37-44,46-47,83H,45H2,1-19H3;/q-1
• InChIKey: RCCKCQNCGIAONW-UHFFFAOYSA-N
• XLogP: 21.79
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1288.65
LogP ≤ 5	21.79
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum?

The IUPAC name of 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum (CID 177264732) is 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum.

What is the SMILES notation for 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum?

The canonical SMILES for 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum is Cc1cc(-c2ccccc2)cc(C)c1-c1cc(-c2[c-]c(-c3nc4ccccc4n3-c3c(C(C)C)cc(-c4ccc5c6c(cccc46)C(C)(C)CC5(C)C)cc3C(C)C)cc(C(C)(C)C)c2)nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c1.[Pt].

What is the InChIKey of 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum?

The InChIKey is RCCKCQNCGIAONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C79H86N3O.Pt/c1-46(2)60-39-52(58-32-33-64-71-59(58)28-25-29-63(71)78(16,17)45-79(64,18)19)40-61(47(3)4)72(60)82-69-31-24-23-30-66(69)81-74(82)55-36-53(37-56(38-55)75(7,8)9)67-41-54(70-48(5)34-51(35-49(70)6)50-26-21-20-22-27-50)42-68(80-67)62-43-57(76(10,11)12)44-65(73(62)83)77(13,14)15;/h20-35,37-44,46-47,83H,45H2,1-19H3;/q-1;.

What are the key properties of 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum?

2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum has a molecular weight of 1288.65 g/mol, XLogP of 21.79, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-ditert-butyl-6-[6-[3-tert-butyl-5-[1-[2,6-di(propan-2-yl)-4-(4,4,6,6-tetramethyl-5H-phenalen-1-yl)phenyl]benzimidazol-2-yl]benzene-6-id-1-yl]-4-(2,6-dimethyl-4-phenylphenyl)-2-pyridinyl]phenol;platinum is sourced from PubChem (CID 177264732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).