tris(4-methylphenyl)-propan-2-yloxysilane

C24H28OSi — CID 139908484

IUPACtris(4-methylphenyl)-propan-2-yloxysilane
SMILESCc1ccc([Si](OC(C)C)(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H28OSi/c1-18(2)25-26(22-12-6-19(3)7-13-22,23-14-8-20(4)9-15-23)24-16-10-21(5)11-17-24/h6-18H,1-5H3
InChIKeyJMYOCCILFDETDO-UHFFFAOYSA-N
MW360.57 g/mol
LogP4.00
Rot. Bonds5

About tris(4-methylphenyl)-propan-2-yloxysilane

tris(4-methylphenyl)-propan-2-yloxysilane (PubChem CID 139908484) has the molecular formula C24H28OSi and a molecular weight of 360.57 g/mol. Its IUPAC name is tris(4-methylphenyl)-propan-2-yloxysilane.

Molecular Properties

Compound Nametris(4-methylphenyl)-propan-2-yloxysilane
PubChem CID139908484
Molecular FormulaC24H28OSi
Molecular Weight360.57 g/mol
Exact Mass360.19
IUPAC Nametris(4-methylphenyl)-propan-2-yloxysilane
SMILESCc1ccc([Si](OC(C)C)(c2ccc(C)cc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C24H28OSi/c1-18(2)25-26(22-12-6-19(3)7-13-22,23-14-8-20(4)9-15-23)24-16-10-21(5)11-17-24/h6-18H,1-5H3
InChIKeyJMYOCCILFDETDO-UHFFFAOYSA-N
XLogP4.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.57
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tris(4-methylphenyl)-propan-2-yloxysilane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tris(4-methylphenyl)-propan-2-yloxysilane?
The IUPAC name of tris(4-methylphenyl)-propan-2-yloxysilane (CID 139908484) is tris(4-methylphenyl)-propan-2-yloxysilane.
What is the SMILES notation for tris(4-methylphenyl)-propan-2-yloxysilane?
The canonical SMILES for tris(4-methylphenyl)-propan-2-yloxysilane is Cc1ccc([Si](OC(C)C)(c2ccc(C)cc2)c2ccc(C)cc2)cc1.
What is the InChIKey of tris(4-methylphenyl)-propan-2-yloxysilane?
The InChIKey is JMYOCCILFDETDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28OSi/c1-18(2)25-26(22-12-6-19(3)7-13-22,23-14-8-20(4)9-15-23)24-16-10-21(5)11-17-24/h6-18H,1-5H3.
What are the key properties of tris(4-methylphenyl)-propan-2-yloxysilane?
tris(4-methylphenyl)-propan-2-yloxysilane has a molecular weight of 360.57 g/mol, XLogP of 4.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tris(4-methylphenyl)-propan-2-yloxysilane is sourced from PubChem (CID 139908484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).