2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane

C87H146O7Si5 — CID 158092605

IUPAC2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane
SMILESC.C.C.CCCC[Si](C)(C)O[Si](C)(C)CCCCCCCCCCC(c1cc(C(C)(C)C)c(O)cc1C)c1cc(C(C)(C)C)c(O)cc1C.CCCC[Si](C)(C)O[Si](O[Si](C)(C)CCCCCCCCCCC(c1ccc(O)cc1)c1ccc(O)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C43H62O4Si3.C41H72O3Si2.3CH4/c1-6-7-35-48(2,3)46-50(41-22-16-14-17-23-41,42-24-18-15-19-25-42)47-49(4,5)36-21-13-11-9-8-10-12-20-26-43(37-27-31-39(44)32-28-37)38-29-33-40(45)34-30-38;1-14-15-25-45(10,11)44-46(12,13)26-23-21-19-17-16-18-20-22-24-33(34-29-36(40(4,5)6)38(42)27-31(34)2)35-30-37(41(7,8)9)39(43)28-32(35)3;;;/h14-19,22-25,27-34,43-45H,6-13,20-21,26,35-36H2,1-5H3;27-30,33,42-43H,14-26H2,1-13H3;3*1H4
InChIKeyFOHCLXWFOWINDJ-UHFFFAOYSA-N
MW1444.55 g/mol
LogP26.33
Rot. Bonds40

About 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane

2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane (PubChem CID 158092605) has the molecular formula C87H146O7Si5 and a molecular weight of 1444.55 g/mol. Its IUPAC name is 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane.

Molecular Properties

Compound Name2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane
PubChem CID158092605
Molecular FormulaC87H146O7Si5
Molecular Weight1444.55 g/mol
Exact Mass1442.99
IUPAC Name2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane
SMILESC.C.C.CCCC[Si](C)(C)O[Si](C)(C)CCCCCCCCCCC(c1cc(C(C)(C)C)c(O)cc1C)c1cc(C(C)(C)C)c(O)cc1C.CCCC[Si](C)(C)O[Si](O[Si](C)(C)CCCCCCCCCCC(c1ccc(O)cc1)c1ccc(O)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C43H62O4Si3.C41H72O3Si2.3CH4/c1-6-7-35-48(2,3)46-50(41-22-16-14-17-23-41,42-24-18-15-19-25-42)47-49(4,5)36-21-13-11-9-8-10-12-20-26-43(37-27-31-39(44)32-28-37)38-29-33-40(45)34-30-38;1-14-15-25-45(10,11)44-46(12,13)26-23-21-19-17-16-18-20-22-24-33(34-29-36(40(4,5)6)38(42)27-31(34)2)35-30-37(41(7,8)9)39(43)28-32(35)3;;;/h14-19,22-25,27-34,43-45H,6-13,20-21,26,35-36H2,1-5H3;27-30,33,42-43H,14-26H2,1-13H3;3*1H4
InChIKeyFOHCLXWFOWINDJ-UHFFFAOYSA-N
XLogP26.33
TPSA108.61 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds40
Heavy Atoms99
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001444.55
LogP ≤ 526.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane with MolForge

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Related Compounds

2-tert-butyl-4-[1-(5-tert-butyl-4-hydroxy-2-methylphenyl)butyl]-5-methylphenol
CID 162123967
2-tert-butyl-4-[1-(5-tert-butyl-4-hydroxy-2-methylphenyl)butyl]-5-methylphenol;1,3-dihydrobenzimidazole-2-thione
CID 162197740
bis(2-tert-butyl-4-[1-(5-tert-butyl-4-hydroxy-2-methylphenyl)butyl]-5-methylphenol);dihydroxyphosphanyl dihydrogen phosphite;hexane-1,6-diol
CID 157052556
sodium 5,5-bis(5-tert-butyl-4-hydroxy-2-methylphenyl)pentanoate
CID 20829570
2-tert-butyl-4-[4-(5-tert-butyl-4-hydroxy-2-methylphenyl)heptadecyl]-5-methylphenol;dihydroxyphosphanyl dihydrogen phosphite
CID 157394982
2-tert-butyl-4-[1-(5-tert-butyl-4-hydroxy-2-methylphenyl)butyl]-5-methylphenol;octadecyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
CID 123299017
4-[1,11,11-tris(4-hydroxyphenyl)undecyl]phenol
CID 57252582
2-tert-butyl-4-[1-(5-tert-butyl-4-hydroxy-2-methylphenyl)pent-4-enyl]-5-methylphenol
CID 172722860
butyl-[dimethyl(phenyl)silyl]oxy-dimethylsilane
CID 167313973
4-[1-(4-hydroxy-3-methylphenyl)octyl]-2-methylphenol
CID 22321255
benzyl 11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]undecanoate
CID 176610533
2-tert-butyl-6-[1-(3-tert-butyl-2-hydroxyphenyl)hexyl]phenol
CID 15123945

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane?
The IUPAC name of 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane (CID 158092605) is 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane.
What is the SMILES notation for 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane?
The canonical SMILES for 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane is C.C.C.CCCC[Si](C)(C)O[Si](C)(C)CCCCCCCCCCC(c1cc(C(C)(C)C)c(O)cc1C)c1cc(C(C)(C)C)c(O)cc1C.CCCC[Si](C)(C)O[Si](O[Si](C)(C)CCCCCCCCCCC(c1ccc(O)cc1)c1ccc(O)cc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane?
The InChIKey is FOHCLXWFOWINDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H62O4Si3.C41H72O3Si2.3CH4/c1-6-7-35-48(2,3)46-50(41-22-16-14-17-23-41,42-24-18-15-19-25-42)47-49(4,5)36-21-13-11-9-8-10-12-20-26-43(37-27-31-39(44)32-28-37)38-29-33-40(45)34-30-38;1-14-15-25-45(10,11)44-46(12,13)26-23-21-19-17-16-18-20-22-24-33(34-29-36(40(4,5)6)38(42)27-31(34)2)35-30-37(41(7,8)9)39(43)28-32(35)3;;;/h14-19,22-25,27-34,43-45H,6-13,20-21,26,35-36H2,1-5H3;27-30,33,42-43H,14-26H2,1-13H3;3*1H4.
What are the key properties of 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane?
2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane has a molecular weight of 1444.55 g/mol, XLogP of 26.33, 40 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4-[11-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]-1-(5-tert-butyl-4-hydroxy-2-methylphenyl)undecyl]-5-methylphenol;4-[11-[[[butyl(dimethyl)silyl]oxy-diphenylsilyl]oxy-dimethylsilyl]-1-(4-hydroxyphenyl)undecyl]phenol;methane is sourced from PubChem (CID 158092605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).