[2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane

C24H38O2Si2 — CID 14244099

IUPAC[2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane
SMILESCc1ccc(C(C)(O[Si](C)(C)C)C(C)(O[Si](C)(C)C)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H38O2Si2/c1-19-11-15-21(16-12-19)23(3,25-27(5,6)7)24(4,26-28(8,9)10)22-17-13-20(2)14-18-22/h11-18H,1-10H3
InChIKeyBMJNGLCKHAOWNG-UHFFFAOYSA-N
MW414.74 g/mol
LogP7.14
Rot. Bonds7

About [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane

[2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane (PubChem CID 14244099) has the molecular formula C24H38O2Si2 and a molecular weight of 414.74 g/mol. Its IUPAC name is [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane
PubChem CID14244099
Molecular FormulaC24H38O2Si2
Molecular Weight414.74 g/mol
Exact Mass414.24
IUPAC Name[2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane
SMILESCc1ccc(C(C)(O[Si](C)(C)C)C(C)(O[Si](C)(C)C)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H38O2Si2/c1-19-11-15-21(16-12-19)23(3,25-27(5,6)7)24(4,26-28(8,9)10)22-17-13-20(2)14-18-22/h11-18H,1-10H3
InChIKeyBMJNGLCKHAOWNG-UHFFFAOYSA-N
XLogP7.14
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.74
LogP ≤ 57.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane?
The IUPAC name of [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane (CID 14244099) is [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane.
What is the SMILES notation for [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane?
The canonical SMILES for [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane is Cc1ccc(C(C)(O[Si](C)(C)C)C(C)(O[Si](C)(C)C)c2ccc(C)cc2)cc1.
What is the InChIKey of [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane?
The InChIKey is BMJNGLCKHAOWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38O2Si2/c1-19-11-15-21(16-12-19)23(3,25-27(5,6)7)24(4,26-28(8,9)10)22-17-13-20(2)14-18-22/h11-18H,1-10H3.
What are the key properties of [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane?
[2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane has a molecular weight of 414.74 g/mol, XLogP of 7.14, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-bis(4-methylphenyl)-3-trimethylsilyloxybutan-2-yl]oxy-trimethylsilane is sourced from PubChem (CID 14244099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).