tert-butyl-(2-methylpropoxy)-diphenylsilane

C20H28OSi — CID 54521909

IUPACtert-butyl-(2-methylpropoxy)-diphenylsilane
SMILESCC(C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H28OSi/c1-17(2)16-21-22(20(3,4)5,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,16H2,1-5H3
InChIKeyNSAXPIWRFHCVAG-UHFFFAOYSA-N
MW312.53 g/mol
LogP4.22
Rot. Bonds5

About tert-butyl-(2-methylpropoxy)-diphenylsilane

tert-butyl-(2-methylpropoxy)-diphenylsilane (PubChem CID 54521909) has the molecular formula C20H28OSi and a molecular weight of 312.53 g/mol. Its IUPAC name is tert-butyl-(2-methylpropoxy)-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-(2-methylpropoxy)-diphenylsilane
PubChem CID54521909
Molecular FormulaC20H28OSi
Molecular Weight312.53 g/mol
Exact Mass312.19
IUPAC Nametert-butyl-(2-methylpropoxy)-diphenylsilane
SMILESCC(C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H28OSi/c1-17(2)16-21-22(20(3,4)5,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,16H2,1-5H3
InChIKeyNSAXPIWRFHCVAG-UHFFFAOYSA-N
XLogP4.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.53
LogP ≤ 54.22
H-Bond Donors ≤ 50
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 tert-butyl-(2-methylpropoxy)-diphenylsilane?
The IUPAC name of tert-butyl-(2-methylpropoxy)-diphenylsilane (CID 54521909) is tert-butyl-(2-methylpropoxy)-diphenylsilane.
What is the SMILES notation for tert-butyl-(2-methylpropoxy)-diphenylsilane?
The canonical SMILES for tert-butyl-(2-methylpropoxy)-diphenylsilane is CC(C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-(2-methylpropoxy)-diphenylsilane?
The InChIKey is NSAXPIWRFHCVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28OSi/c1-17(2)16-21-22(20(3,4)5,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,16H2,1-5H3.
What are the key properties of tert-butyl-(2-methylpropoxy)-diphenylsilane?
tert-butyl-(2-methylpropoxy)-diphenylsilane has a molecular weight of 312.53 g/mol, XLogP of 4.22, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-methylpropoxy)-diphenylsilane is sourced from PubChem (CID 54521909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).