tert-butyl-dimethyl-(4-phenylphenoxy)silane

C18H24OSi — CID 11150311

IUPACtert-butyl-dimethyl-(4-phenylphenoxy)silane
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H24OSi/c1-18(2,3)20(4,5)19-17-13-11-16(12-14-17)15-9-7-6-8-10-15/h6-14H,1-5H3
InChIKeyQHVVCPJMTSSSCN-UHFFFAOYSA-N
MW284.48 g/mol
LogP5.74
Rot. Bonds3

About tert-butyl-dimethyl-(4-phenylphenoxy)silane

tert-butyl-dimethyl-(4-phenylphenoxy)silane (PubChem CID 11150311) has the molecular formula C18H24OSi and a molecular weight of 284.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-(4-phenylphenoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(4-phenylphenoxy)silane
PubChem CID11150311
Molecular FormulaC18H24OSi
Molecular Weight284.48 g/mol
Exact Mass284.16
IUPAC Nametert-butyl-dimethyl-(4-phenylphenoxy)silane
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H24OSi/c1-18(2,3)20(4,5)19-17-13-11-16(12-14-17)15-9-7-6-8-10-15/h6-14H,1-5H3
InChIKeyQHVVCPJMTSSSCN-UHFFFAOYSA-N
XLogP5.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.48
LogP ≤ 55.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-(4-phenylphenoxy)silane 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 tert-butyl-dimethyl-(4-phenylphenoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(4-phenylphenoxy)silane (CID 11150311) is tert-butyl-dimethyl-(4-phenylphenoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(4-phenylphenoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(4-phenylphenoxy)silane is CC(C)(C)[Si](C)(C)Oc1ccc(-c2ccccc2)cc1.
What is the InChIKey of tert-butyl-dimethyl-(4-phenylphenoxy)silane?
The InChIKey is QHVVCPJMTSSSCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24OSi/c1-18(2,3)20(4,5)19-17-13-11-16(12-14-17)15-9-7-6-8-10-15/h6-14H,1-5H3.
What are the key properties of tert-butyl-dimethyl-(4-phenylphenoxy)silane?
tert-butyl-dimethyl-(4-phenylphenoxy)silane has a molecular weight of 284.48 g/mol, XLogP of 5.74, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(4-phenylphenoxy)silane is sourced from PubChem (CID 11150311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).