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

C69H80F4N3OPtSi- — CID 169052767

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

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum (PubChem CID 169052767) has the molecular formula C69H80F4N3OPtSi- and a molecular weight of 1266.57 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum
• PubChem CID: 169052767
• Molecular Formula: C69H80F4N3OPtSi-
• Molecular Weight: 1266.57 g/mol
• Exact Mass: 1265.57
• IUPAC Name: 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum
• SMILES: CC(C)c1cc(C(F)(F)C(F)(F)[Si](C)(C)C)cc(C(C)C)c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccc(C(C)(C)C)cc3-c3ccccc3)cc(C(C)(C)C)c2)c1.[Pt]
• InChI: InChI=1S/C69H80F4N3OSi.Pt/c1-41(2)52-38-50(68(70,71)69(72,73)78(17,18)19)39-53(42(3)4)60(52)44-30-31-74-57(35-44)46-32-45(33-48(34-46)65(8,9)10)51-26-23-27-59-61(51)75-63(55-37-49(66(11,12)13)40-56(62(55)77)67(14,15)16)76(59)58-29-28-47(64(5,6)7)36-54(58)43-24-21-20-22-25-43;/h20-31,33-42,77H,1-19H3;/q-1
• InChIKey: PRHRTVGYCKSJRR-UHFFFAOYSA-N
• XLogP: 20.30
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 11
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1266.57
LogP ≤ 5	20.30
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

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

The IUPAC name of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum (CID 169052767) is 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum.

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

The canonical SMILES for 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum is CC(C)c1cc(C(F)(F)C(F)(F)[Si](C)(C)C)cc(C(C)C)c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccc(C(C)(C)C)cc3-c3ccccc3)cc(C(C)(C)C)c2)c1.[Pt].

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

The InChIKey is PRHRTVGYCKSJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H80F4N3OSi.Pt/c1-41(2)52-38-50(68(70,71)69(72,73)78(17,18)19)39-53(42(3)4)60(52)44-30-31-74-57(35-44)46-32-45(33-48(34-46)65(8,9)10)51-26-23-27-59-61(51)75-63(55-37-49(66(11,12)13)40-56(62(55)77)67(14,15)16)76(59)58-29-28-47(64(5,6)7)36-54(58)43-24-21-20-22-25-43;/h20-31,33-42,77H,1-19H3;/q-1;.

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

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum has a molecular weight of 1266.57 g/mol, XLogP of 20.30, 11 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-[4-[3-tert-butyl-5-[4-[2,6-di(propan-2-yl)-4-(1,1,2,2-tetrafluoro-2-trimethylsilylethyl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 169052767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).