4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane

C140H132Cl3F6N7Ni5-11 — CID 160697620

About 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane

4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane (PubChem CID 160697620) has the molecular formula C140H132Cl3F6N7Ni5-11 and a molecular weight of 2426.46 g/mol. Its IUPAC name is 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane.

Molecular Properties

• Compound Name: 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane
• PubChem CID: 160697620
• Molecular Formula: C140H132Cl3F6N7Ni5-11
• Molecular Weight: 2426.46 g/mol
• Exact Mass: 2419.63
• IUPAC Name: 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane
• SMILES: CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2[c-]cccc2)c1.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3[c-]cc(C(F)(F)F)cc3)n2)cc1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3[c-]cc(C(F)(F)F)cc3)n2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].[Ni+3].[Ni+3].[c-]1ccccc1-c1cccc(-c2[c-]cccc2)n1.[c-]1ccccc1-c1cccc(-c2[c-]cccc2)n1.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12
• InChI: InChI=1S/2C23H20F3N.C21H19N.2C17H11N.2C12H8N.5C3H7.3ClH.5Ni/c2*1-15-5-7-16(8-6-15)20-13-19(22(2,3)4)14-21(27-20)17-9-11-18(12-10-17)23(24,25)26;1-21(2,3)18-14-19(16-10-6-4-7-11-16)22-20(15-18)17-12-8-5-9-13-17;2*1-3-8-14(9-4-1)16-12-7-13-17(18-16)15-10-5-2-6-11-15;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;5*1-3-2;;;;;;;;/h2*5-7,9,11-14H,1-4H3;4-10,12,14-15H,1-3H3;2*1-8,10,12-13H;2*1-8H;5*3H,1-2H3;3*1H;;;;;/q5*-2;7*-1;;;;3*+1;2*+3/p-3
• InChIKey: OBEDXDGSENIUDT-UHFFFAOYSA-K
• XLogP: 40.74
• TPSA: 92.65 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2426.46
LogP ≤ 5	40.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane?

The IUPAC name of 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane (CID 160697620) is 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane.

What is the SMILES notation for 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane?

The canonical SMILES for 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane is CC(C)(C)c1cc(-c2[c-]cccc2)nc(-c2[c-]cccc2)c1.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.C[CH-]C.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3[c-]cc(C(F)(F)F)cc3)n2)cc1.Cc1c[c-]c(-c2cc(C(C)(C)C)cc(-c3[c-]cc(C(F)(F)F)cc3)n2)cc1.Cl[Ni].Cl[Ni].Cl[Ni].[Ni+3].[Ni+3].[c-]1ccccc1-c1cccc(-c2[c-]cccc2)n1.[c-]1ccccc1-c1cccc(-c2[c-]cccc2)n1.c1ccc2c(c1)[n-]c1ccccc12.c1ccc2c(c1)[n-]c1ccccc12.

What is the InChIKey of 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane?

The InChIKey is OBEDXDGSENIUDT-UHFFFAOYSA-K. The full InChI is InChI=1S/2C23H20F3N.C21H19N.2C17H11N.2C12H8N.5C3H7.3ClH.5Ni/c2*1-15-5-7-16(8-6-15)20-13-19(22(2,3)4)14-21(27-20)17-9-11-18(12-10-17)23(24,25)26;1-21(2,3)18-14-19(16-10-6-4-7-11-16)22-20(15-18)17-12-8-5-9-13-17;2*1-3-8-14(9-4-1)16-12-7-13-17(18-16)15-10-5-2-6-11-15;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;5*1-3-2;;;;;;;;/h2*5-7,9,11-14H,1-4H3;4-10,12,14-15H,1-3H3;2*1-8,10,12-13H;2*1-8H;5*3H,1-2H3;3*1H;;;;;/q5*-2;7*-1;;;;3*+1;2*+3/p-3.

What are the key properties of 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane?

4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane has a molecular weight of 2426.46 g/mol, XLogP of 40.74, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2,6-di(phenyl)pyridine;bis(4-tert-butyl-2-(4-methylbenzene-6-id-1-yl)-6-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine);bis(carbazol-9-ide);chloronickel;bis(2,6-di(phenyl)pyridine);bis(nickel(3+));propane is sourced from PubChem (CID 160697620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).