4-methyl-2-tri(propan-2-yl)silylphenol

C16H28OSi — CID 135072334

IUPAC4-methyl-2-tri(propan-2-yl)silylphenol
SMILESCc1ccc(O)c([Si](C(C)C)(C(C)C)C(C)C)c1
InChIInChI=1S/C16H28OSi/c1-11(2)18(12(3)4,13(5)6)16-10-14(7)8-9-15(16)17/h8-13,17H,1-7H3
InChIKeyKUQBHRRLEJPYAH-UHFFFAOYSA-N
MW264.49 g/mol
LogP4.59
Rot. Bonds4

About 4-methyl-2-tri(propan-2-yl)silylphenol

4-methyl-2-tri(propan-2-yl)silylphenol (PubChem CID 135072334) has the molecular formula C16H28OSi and a molecular weight of 264.49 g/mol. Its IUPAC name is 4-methyl-2-tri(propan-2-yl)silylphenol.

Molecular Properties

Compound Name4-methyl-2-tri(propan-2-yl)silylphenol
PubChem CID135072334
Molecular FormulaC16H28OSi
Molecular Weight264.49 g/mol
Exact Mass264.19
IUPAC Name4-methyl-2-tri(propan-2-yl)silylphenol
SMILESCc1ccc(O)c([Si](C(C)C)(C(C)C)C(C)C)c1
InChIInChI=1S/C16H28OSi/c1-11(2)18(12(3)4,13(5)6)16-10-14(7)8-9-15(16)17/h8-13,17H,1-7H3
InChIKeyKUQBHRRLEJPYAH-UHFFFAOYSA-N
XLogP4.59
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.49
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-methyl-2-tri(propan-2-yl)silylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-tert-Pentylphenol
CID 6643
P-Cresol
CID 2879
Diethylstilbestrol
CID 448537
O-Cresol
CID 335
M-Cresol
CID 342
2,4-Dimethylphenol
CID 7771
Dienestrol
CID 667476
4-tert-Butylphenol
CID 7393
4-Nonylphenol
CID 1752
4-Tert-octylphenol
CID 8814
2-Ethylphenol
CID 6997
3,4-Dimethylphenol
CID 7249

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-tri(propan-2-yl)silylphenol?
The IUPAC name of 4-methyl-2-tri(propan-2-yl)silylphenol (CID 135072334) is 4-methyl-2-tri(propan-2-yl)silylphenol.
What is the SMILES notation for 4-methyl-2-tri(propan-2-yl)silylphenol?
The canonical SMILES for 4-methyl-2-tri(propan-2-yl)silylphenol is Cc1ccc(O)c([Si](C(C)C)(C(C)C)C(C)C)c1.
What is the InChIKey of 4-methyl-2-tri(propan-2-yl)silylphenol?
The InChIKey is KUQBHRRLEJPYAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28OSi/c1-11(2)18(12(3)4,13(5)6)16-10-14(7)8-9-15(16)17/h8-13,17H,1-7H3.
What are the key properties of 4-methyl-2-tri(propan-2-yl)silylphenol?
4-methyl-2-tri(propan-2-yl)silylphenol has a molecular weight of 264.49 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-tri(propan-2-yl)silylphenol is sourced from PubChem (CID 135072334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).