[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane

C62H82O3Si2 — CID 57108762

IUPAC[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane
SMILESCOc1ccc(CCCCCCCCCC(C)(C)[Si](O[Si](c2ccccc2)(c2ccccc2)C(C)(C)CCCCCCCCCc2ccc(OC)cc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C62H82O3Si2/c1-61(2,51-31-15-11-7-9-13-21-33-53-43-47-55(63-5)48-44-53)66(57-35-23-17-24-36-57,58-37-25-18-26-38-58)65-67(59-39-27-19-28-40-59,60-41-29-20-30-42-60)62(3,4)52-32-16-12-8-10-14-22-34-54-45-49-56(64-6)50-46-54/h17-20,23-30,35-50H,7-16,21-22,31-34,51-52H2,1-6H3
InChIKeyFSDRZKDVEHEMRJ-UHFFFAOYSA-N
MW931.51 g/mol
LogP14.83
Rot. Bonds30

About [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane

[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane (PubChem CID 57108762) has the molecular formula C62H82O3Si2 and a molecular weight of 931.51 g/mol. Its IUPAC name is [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane.

Molecular Properties

Compound Name[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane
PubChem CID57108762
Molecular FormulaC62H82O3Si2
Molecular Weight931.51 g/mol
Exact Mass930.58
IUPAC Name[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane
SMILESCOc1ccc(CCCCCCCCCC(C)(C)[Si](O[Si](c2ccccc2)(c2ccccc2)C(C)(C)CCCCCCCCCc2ccc(OC)cc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C62H82O3Si2/c1-61(2,51-31-15-11-7-9-13-21-33-53-43-47-55(63-5)48-44-53)66(57-35-23-17-24-36-57,58-37-25-18-26-38-58)65-67(59-39-27-19-28-40-59,60-41-29-20-30-42-60)62(3,4)52-32-16-12-8-10-14-22-34-54-45-49-56(64-6)50-46-54/h17-20,23-30,35-50H,7-16,21-22,31-34,51-52H2,1-6H3
InChIKeyFSDRZKDVEHEMRJ-UHFFFAOYSA-N
XLogP14.83
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds30
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500931.51
LogP ≤ 514.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 54077830
[4-(3,5-dimethoxyphenyl)-2-methylbutan-2-yl]-[[4-(3,5-dimethoxyphenyl)-2-methylbutan-2-yl]-diphenylsilyl]oxy-diphenylsilane
CID 70074975
1-methoxy-4-(4-phenylbutyl)benzene
CID 15647797
1-(6,6-dimethyloctyl)-4-methoxybenzene
CID 54371242
7-(4-methoxyphenyl)-2,2-dimethylheptanoic acid
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hydroxy-(2-methyl-6-phenylhexan-2-yl)-diphenylsilane
CID 70887086
1-tert-butyl-4-[2-(4-tert-butylphenyl)propan-2-yl]benzene;1-hexyl-4-[2-(4-hexylphenyl)propan-2-yl]benzene;1-methoxy-4-(2-phenylpropan-2-yl)benzene;1-octyl-4-[2-(4-octylphenyl)propan-2-yl]benzene
CID 123210298
2-(4-hexylphenoxy)-4,6-diphenoxy-1,3,5-triazine;2,4,6-tris(4-methoxyphenoxy)-1,3,5-triazine
CID 167563213
6-(4-methoxyphenyl)hexane-1-thiol
CID 10799192
5-(4-methoxyphenyl)pentan-1-amine
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10-(4-methoxyphenyl)decan-1-amine
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4-[3-(4-methoxyphenyl)propyl]benzoic acid
CID 102282707

Frequently Asked Questions

What is the IUPAC name of [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane?
The IUPAC name of [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane (CID 57108762) is [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane.
What is the SMILES notation for [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane?
The canonical SMILES for [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane is COc1ccc(CCCCCCCCCC(C)(C)[Si](O[Si](c2ccccc2)(c2ccccc2)C(C)(C)CCCCCCCCCc2ccc(OC)cc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane?
The InChIKey is FSDRZKDVEHEMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H82O3Si2/c1-61(2,51-31-15-11-7-9-13-21-33-53-43-47-55(63-5)48-44-53)66(57-35-23-17-24-36-57,58-37-25-18-26-38-58)65-67(59-39-27-19-28-40-59,60-41-29-20-30-42-60)62(3,4)52-32-16-12-8-10-14-22-34-54-45-49-56(64-6)50-46-54/h17-20,23-30,35-50H,7-16,21-22,31-34,51-52H2,1-6H3.
What are the key properties of [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane?
[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane has a molecular weight of 931.51 g/mol, XLogP of 14.83, 30 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [11-(4-methoxyphenyl)-2-methylundecan-2-yl]-[[11-(4-methoxyphenyl)-2-methylundecan-2-yl]-diphenylsilyl]oxy-diphenylsilane is sourced from PubChem (CID 57108762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).