2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)

C86H82BrN13Pt2 — CID 157138678

About 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)

2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+) (PubChem CID 157138678) has the molecular formula C86H82BrN13Pt2 and a molecular weight of 1767.75 g/mol. Its IUPAC name is 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+).

Molecular Properties

• Compound Name: 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)
• PubChem CID: 157138678
• Molecular Formula: C86H82BrN13Pt2
• Molecular Weight: 1767.75 g/mol
• Exact Mass: 1765.53
• IUPAC Name: 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)
• SMILES: C.CC(C)(C)NN=[Pt].CC(C)(C)c1ccnc(-n2c3[c-]c(-n4c5[c-]c(-n6cccn6)ccc5c5ccccc54)ccc3c3ccccc32)c1.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(-n4c5ccccc5c5ccc(-n6cccn6)cc54)cc32)c1.CC(C)(C)c1ccnc(Br)c1.[Pt+2]
• InChI: InChI=1S/C36H29N5.C36H27N5.C9H12BrN.C4H10N2.CH4.2Pt/c2*1-36(2,3)24-17-19-37-35(21-24)41-32-12-7-5-10-28(32)30-16-14-26(23-34(30)41)40-31-11-6-4-9-27(31)29-15-13-25(22-33(29)40)39-20-8-18-38-39;1-9(2,3)7-4-5-11-8(10)6-7;1-4(2,3)6-5;;;/h4-23H,1-3H3;4-21H,1-3H3;4-6H,1-3H3;6H,1-3H3;1H4;;/q;-2;;;;;+2
• InChIKey: BMCDMFKCYRBFAL-UHFFFAOYSA-N
• XLogP: 21.91
• TPSA: 118.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 13
• Rotatable Bonds: 7
• Heavy Atoms: 102
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1767.75
LogP ≤ 5	21.91
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)?

The IUPAC name of 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+) (CID 157138678) is 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+).

What is the SMILES notation for 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)?

The canonical SMILES for 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+) is C.CC(C)(C)NN=[Pt].CC(C)(C)c1ccnc(-n2c3[c-]c(-n4c5[c-]c(-n6cccn6)ccc5c5ccccc54)ccc3c3ccccc32)c1.CC(C)(C)c1ccnc(-n2c3ccccc3c3ccc(-n4c5ccccc5c5ccc(-n6cccn6)cc54)cc32)c1.CC(C)(C)c1ccnc(Br)c1.[Pt+2].

What is the InChIKey of 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)?

The InChIKey is BMCDMFKCYRBFAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H29N5.C36H27N5.C9H12BrN.C4H10N2.CH4.2Pt/c2*1-36(2,3)24-17-19-37-35(21-24)41-32-12-7-5-10-28(32)30-16-14-26(23-34(30)41)40-31-11-6-4-9-27(31)29-15-13-25(22-33(29)40)39-20-8-18-38-39;1-9(2,3)7-4-5-11-8(10)6-7;1-4(2,3)6-5;;;/h4-23H,1-3H3;4-21H,1-3H3;4-6H,1-3H3;6H,1-3H3;1H4;;/q;-2;;;;;+2.

What are the key properties of 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+)?

2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+) has a molecular weight of 1767.75 g/mol, XLogP of 21.91, 7 rotatable bonds, 1 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-bromo-4-tert-butylpyridine;(tert-butylhydrazinylidene)platinum;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-yl-1H-carbazol-1-id-9-yl)-1H-carbazol-1-ide;9-(4-tert-butyl-2-pyridinyl)-2-(2-pyrazol-1-ylcarbazol-9-yl)carbazole;methane;platinum(2+) is sourced from PubChem (CID 157138678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).