2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane

C22H32O2Si — CID 91738929

IUPAC2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane
SMILESCCC(O[Si](OCC(C)C)(c1ccccc1)c1ccccc1)C(C)C
InChIInChI=1S/C22H32O2Si/c1-6-22(19(4)5)24-25(23-17-18(2)3,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18-19,22H,6,17H2,1-5H3
InChIKeyZEJGLOHJVHTSTJ-UHFFFAOYSA-N
MW356.58 g/mol
LogP4.37
Rot. Bonds9

About 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane

2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane (PubChem CID 91738929) has the molecular formula C22H32O2Si and a molecular weight of 356.58 g/mol. Its IUPAC name is 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane.

Molecular Properties

Compound Name2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane
PubChem CID91738929
Molecular FormulaC22H32O2Si
Molecular Weight356.58 g/mol
Exact Mass356.22
IUPAC Name2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane
SMILESCCC(O[Si](OCC(C)C)(c1ccccc1)c1ccccc1)C(C)C
InChIInChI=1S/C22H32O2Si/c1-6-22(19(4)5)24-25(23-17-18(2)3,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18-19,22H,6,17H2,1-5H3
InChIKeyZEJGLOHJVHTSTJ-UHFFFAOYSA-N
XLogP4.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.58
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane?
The IUPAC name of 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane (CID 91738929) is 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane.
What is the SMILES notation for 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane?
The canonical SMILES for 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane is CCC(O[Si](OCC(C)C)(c1ccccc1)c1ccccc1)C(C)C.
What is the InChIKey of 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane?
The InChIKey is ZEJGLOHJVHTSTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32O2Si/c1-6-22(19(4)5)24-25(23-17-18(2)3,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18-19,22H,6,17H2,1-5H3.
What are the key properties of 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane?
2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane has a molecular weight of 356.58 g/mol, XLogP of 4.37, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpentan-3-yloxy-(2-methylpropoxy)-diphenylsilane is sourced from PubChem (CID 91738929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).