2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine

C178H260O18P6 — CID 159770605

About 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine

2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine (PubChem CID 159770605) has the molecular formula C178H260O18P6 and a molecular weight of 2873.86 g/mol. Its IUPAC name is 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine.

Molecular Properties

• Compound Name: 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine
• PubChem CID: 159770605
• Molecular Formula: C178H260O18P6
• Molecular Weight: 2873.86 g/mol
• Exact Mass: 2871.79
• IUPAC Name: 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine
• SMILES: CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2Op2oc3c(C(C)(C)C)cc(C(C)(C)C)cc3c3cc(C(C)(C)C)cc(C(C)(C)C)c3o2)c(OP2OCCCO2)c(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2Op2oc3c(C(C)(C)C)cc(C(C)(C)C)cc3c3cc(C(C)(C)C)cc(C(C)(C)C)c3o2)c(OP2OCCO2)c(C(C)(C)C)c1.CC1(C)COP(Oc2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3Op3oc4c(C(C)(C)C)cc(C(C)(C)C)cc4c4cc(C(C)(C)C)cc(C(C)(C)C)c4o3)cc(C(C)(C)C)cc2C(C)(C)C)OC1
• InChI: InChI=1S/C61H90O6P2.C59H86O6P2.C58H84O6P2/c1-53(2,3)37-27-41(49(45(31-37)57(13,14)15)64-68-62-35-61(25,26)36-63-68)42-28-38(54(4,5)6)32-46(58(16,17)18)50(42)65-69-66-51-43(29-39(55(7,8)9)33-47(51)59(19,20)21)44-30-40(56(10,11)12)34-48(52(44)67-69)60(22,23)24;1-52(2,3)36-28-40(48(44(32-36)56(13,14)15)62-66-60-26-25-27-61-66)41-29-37(53(4,5)6)33-45(57(16,17)18)49(41)63-67-64-50-42(30-38(54(7,8)9)34-46(50)58(19,20)21)43-31-39(55(10,11)12)35-47(51(43)65-67)59(22,23)24;1-51(2,3)35-27-39(47(43(31-35)55(13,14)15)61-65-59-25-26-60-65)40-28-36(52(4,5)6)32-44(56(16,17)18)48(40)62-66-63-49-41(29-37(53(7,8)9)33-45(49)57(19,20)21)42-30-38(54(10,11)12)34-46(50(42)64-66)58(22,23)24/h27-34H,35-36H2,1-26H3;28-35H,25-27H2,1-24H3;27-34H,25-26H2,1-24H3
• InChIKey: NGBGUOFOPYLAET-UHFFFAOYSA-N
• XLogP: 57.91
• TPSA: 189.60 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 15
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2873.86
LogP ≤ 5	57.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine?

The IUPAC name of 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine (CID 159770605) is 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine.

What is the SMILES notation for 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine?

The canonical SMILES for 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine is CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2Op2oc3c(C(C)(C)C)cc(C(C)(C)C)cc3c3cc(C(C)(C)C)cc(C(C)(C)C)c3o2)c(OP2OCCCO2)c(C(C)(C)C)c1.CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2Op2oc3c(C(C)(C)C)cc(C(C)(C)C)cc3c3cc(C(C)(C)C)cc(C(C)(C)C)c3o2)c(OP2OCCO2)c(C(C)(C)C)c1.CC1(C)COP(Oc2c(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3Op3oc4c(C(C)(C)C)cc(C(C)(C)C)cc4c4cc(C(C)(C)C)cc(C(C)(C)C)c4o3)cc(C(C)(C)C)cc2C(C)(C)C)OC1.

What is the InChIKey of 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine?

The InChIKey is NGBGUOFOPYLAET-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H90O6P2.C59H86O6P2.C58H84O6P2/c1-53(2,3)37-27-41(49(45(31-37)57(13,14)15)64-68-62-35-61(25,26)36-63-68)42-28-38(54(4,5)6)32-46(58(16,17)18)50(42)65-69-66-51-43(29-39(55(7,8)9)33-47(51)59(19,20)21)44-30-40(56(10,11)12)34-48(52(44)67-69)60(22,23)24;1-52(2,3)36-28-40(48(44(32-36)56(13,14)15)62-66-60-26-25-27-61-66)41-29-37(53(4,5)6)33-45(57(16,17)18)49(41)63-67-64-50-42(30-38(54(7,8)9)34-46(50)58(19,20)21)43-31-39(55(10,11)12)35-47(51(43)65-67)59(22,23)24;1-51(2,3)35-27-39(47(43(31-35)55(13,14)15)61-65-59-25-26-60-65)40-28-36(52(4,5)6)32-44(56(16,17)18)48(40)62-66-63-49-41(29-37(53(7,8)9)33-45(49)57(19,20)21)42-30-38(54(10,11)12)34-46(50(42)64-66)58(22,23)24/h27-34H,35-36H2,1-26H3;28-35H,25-27H2,1-24H3;27-34H,25-26H2,1-24H3.

What are the key properties of 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine?

2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine has a molecular weight of 2873.86 g/mol, XLogP of 57.91, 15 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-[(5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy]phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphosphinan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine;2,4,8,10-tetratert-butyl-6-[2,4-ditert-butyl-6-[3,5-ditert-butyl-2-(1,3,2-dioxaphospholan-2-yloxy)phenyl]phenoxy]benzo[d][1,3,2]benzodioxaphosphepine is sourced from PubChem (CID 159770605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).