bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine

C143H219FNO11P5 — CID 162252939

About bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine

bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine (PubChem CID 162252939) has the molecular formula C143H219FNO11P5 and a molecular weight of 2302.19 g/mol. Its IUPAC name is bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine.

Molecular Properties

• Compound Name: bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine
• PubChem CID: 162252939
• Molecular Formula: C143H219FNO11P5
• Molecular Weight: 2302.19 g/mol
• Exact Mass: 2300.53
• IUPAC Name: bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine
• SMILES: CC(C)(C)c1cc(C(C)(C)C)c2op(OCCN)oc3c(C(C)(C)C)cc(C(C)(C)C)cc3c2c1.CC1c2cc(C(C)(C)C)cc(C(C)(C)C)c2OP(F)Oc2c1cc(C(C)(C)C)cc2C(C)(C)C.CCCCCCCCCC.CCOP(Oc1c(C)cc(C(C)(C)C)cc1C(C)(C)C)Oc1c(C)cc(C(C)(C)C)cc1C(C)(C)C.Cc1ccc(P(Oc2ccc(C(C)(C)C)cc2C(C)(C)C)Oc2ccc(C(C)(C)C)cc2C(C)(C)C)cc1.POc1ccccc1
• InChI: InChI=1S/C35H49O2P.C32H51O3P.C30H44FO2P.C30H46NO3P.C10H22.C6H7OP/c1-24-14-18-27(19-15-24)38(36-30-20-16-25(32(2,3)4)22-28(30)34(8,9)10)37-31-21-17-26(33(5,6)7)23-29(31)35(11,12)13;1-16-33-36(34-27-21(2)17-23(29(4,5)6)19-25(27)31(10,11)12)35-28-22(3)18-24(30(7,8)9)20-26(28)32(13,14)15;1-18-21-14-19(27(2,3)4)16-23(29(8,9)10)25(21)32-34(31)33-26-22(18)15-20(28(5,6)7)17-24(26)30(11,12)13;1-27(2,3)19-15-21-22-16-20(28(4,5)6)18-24(30(10,11)12)26(22)34-35(32-14-13-31)33-25(21)23(17-19)29(7,8)9;1-3-5-7-9-10-8-6-4-2;8-7-6-4-2-1-3-5-6/h14-23H,1-13H3;17-20H,16H2,1-15H3;14-18H,1-13H3;15-18H,13-14,31H2,1-12H3;3-10H2,1-2H3;1-5H,8H2
• InChIKey: ZYFLZPGELIOHSY-UHFFFAOYSA-N
• XLogP: 45.36
• TPSA: 135.37 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 12
• Rotatable Bonds: 22
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2302.19
LogP ≤ 5	45.36
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine?

The IUPAC name of bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine (CID 162252939) is bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine.

What is the SMILES notation for bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine?

The canonical SMILES for bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine is CC(C)(C)c1cc(C(C)(C)C)c2op(OCCN)oc3c(C(C)(C)C)cc(C(C)(C)C)cc3c2c1.CC1c2cc(C(C)(C)C)cc(C(C)(C)C)c2OP(F)Oc2c1cc(C(C)(C)C)cc2C(C)(C)C.CCCCCCCCCC.CCOP(Oc1c(C)cc(C(C)(C)C)cc1C(C)(C)C)Oc1c(C)cc(C(C)(C)C)cc1C(C)(C)C.Cc1ccc(P(Oc2ccc(C(C)(C)C)cc2C(C)(C)C)Oc2ccc(C(C)(C)C)cc2C(C)(C)C)cc1.POc1ccccc1.

What is the InChIKey of bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine?

The InChIKey is ZYFLZPGELIOHSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H49O2P.C32H51O3P.C30H44FO2P.C30H46NO3P.C10H22.C6H7OP/c1-24-14-18-27(19-15-24)38(36-30-20-16-25(32(2,3)4)22-28(30)34(8,9)10)37-31-21-17-26(33(5,6)7)23-29(31)35(11,12)13;1-16-33-36(34-27-21(2)17-23(29(4,5)6)19-25(27)31(10,11)12)35-28-22(3)18-24(30(7,8)9)20-26(28)32(13,14)15;1-18-21-14-19(27(2,3)4)16-23(29(8,9)10)25(21)32-34(31)33-26-22(18)15-20(28(5,6)7)17-24(26)30(11,12)13;1-27(2,3)19-15-21-22-16-20(28(4,5)6)18-24(30(10,11)12)26(22)34-35(32-14-13-31)33-25(21)23(17-19)29(7,8)9;1-3-5-7-9-10-8-6-4-2;8-7-6-4-2-1-3-5-6/h14-23H,1-13H3;17-20H,16H2,1-15H3;14-18H,1-13H3;15-18H,13-14,31H2,1-12H3;3-10H2,1-2H3;1-5H,8H2.

What are the key properties of bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine?

bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine has a molecular weight of 2302.19 g/mol, XLogP of 45.36, 22 rotatable bonds, 1 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,4-ditert-butyl-6-methylphenyl) ethyl phosphite;bis(2,4-ditert-butylphenoxy)-(4-methylphenyl)phosphane;decane;phenoxyphosphane;2-(2,4,8,10-tetratert-butylbenzo[d][1,3,2]benzodioxaphosphepin-6-yl)oxyethanamine;1,3,7,9-tetratert-butyl-11-fluoro-5-methyl-5H-benzo[d][1,3,2]benzodioxaphosphocine is sourced from PubChem (CID 162252939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).