4-trimethylsilylphenol

C9H14OSi — CID 25732

IUPAC4-trimethylsilylphenol
SMILESC[Si](C)(C)c1ccc(O)cc1
InChIInChI=1S/C9H14OSi/c1-11(2,3)9-6-4-8(10)5-7-9/h4-7,10H,1-3H3
InChIKeyZOMMEPFDNFYOHO-UHFFFAOYSA-N
MW166.30 g/mol
LogP1.94
Rot. Bonds1

About 4-trimethylsilylphenol

4-trimethylsilylphenol (PubChem CID 25732) has the molecular formula C9H14OSi and a molecular weight of 166.30 g/mol. Its IUPAC name is 4-trimethylsilylphenol.

Molecular Properties

Compound Name4-trimethylsilylphenol
PubChem CID25732
Molecular FormulaC9H14OSi
Molecular Weight166.30 g/mol
Exact Mass166.08
IUPAC Name4-trimethylsilylphenol
SMILESC[Si](C)(C)c1ccc(O)cc1
InChIInChI=1S/C9H14OSi/c1-11(2,3)9-6-4-8(10)5-7-9/h4-7,10H,1-3H3
InChIKeyZOMMEPFDNFYOHO-UHFFFAOYSA-N
XLogP1.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.30
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 4-trimethylsilylphenol?
The IUPAC name of 4-trimethylsilylphenol (CID 25732) is 4-trimethylsilylphenol.
What is the SMILES notation for 4-trimethylsilylphenol?
The canonical SMILES for 4-trimethylsilylphenol is C[Si](C)(C)c1ccc(O)cc1.
What is the InChIKey of 4-trimethylsilylphenol?
The InChIKey is ZOMMEPFDNFYOHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14OSi/c1-11(2,3)9-6-4-8(10)5-7-9/h4-7,10H,1-3H3.
What are the key properties of 4-trimethylsilylphenol?
4-trimethylsilylphenol has a molecular weight of 166.30 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-trimethylsilylphenol is sourced from PubChem (CID 25732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).