2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane

C24H36O2Si — CID 91740897

IUPAC2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane
SMILESCCC(O[Si](OCCCC(C)C)(c1ccccc1)c1ccccc1)C(C)C
InChIInChI=1S/C24H36O2Si/c1-6-24(21(4)5)26-27(22-15-9-7-10-16-22,23-17-11-8-12-18-23)25-19-13-14-20(2)3/h7-12,15-18,20-21,24H,6,13-14,19H2,1-5H3
InChIKeyRDHVKXKZQZYMDI-UHFFFAOYSA-N
MW384.64 g/mol
LogP5.15
Rot. Bonds11

About 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane

2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane (PubChem CID 91740897) has the molecular formula C24H36O2Si and a molecular weight of 384.64 g/mol. Its IUPAC name is 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane.

Molecular Properties

Compound Name2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane
PubChem CID91740897
Molecular FormulaC24H36O2Si
Molecular Weight384.64 g/mol
Exact Mass384.25
IUPAC Name2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane
SMILESCCC(O[Si](OCCCC(C)C)(c1ccccc1)c1ccccc1)C(C)C
InChIInChI=1S/C24H36O2Si/c1-6-24(21(4)5)26-27(22-15-9-7-10-16-22,23-17-11-8-12-18-23)25-19-13-14-20(2)3/h7-12,15-18,20-21,24H,6,13-14,19H2,1-5H3
InChIKeyRDHVKXKZQZYMDI-UHFFFAOYSA-N
XLogP5.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.64
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane?
The IUPAC name of 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane (CID 91740897) is 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane.
What is the SMILES notation for 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane?
The canonical SMILES for 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane is CCC(O[Si](OCCCC(C)C)(c1ccccc1)c1ccccc1)C(C)C.
What is the InChIKey of 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane?
The InChIKey is RDHVKXKZQZYMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36O2Si/c1-6-24(21(4)5)26-27(22-15-9-7-10-16-22,23-17-11-8-12-18-23)25-19-13-14-20(2)3/h7-12,15-18,20-21,24H,6,13-14,19H2,1-5H3.
What are the key properties of 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane?
2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane has a molecular weight of 384.64 g/mol, XLogP of 5.15, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpentan-3-yloxy-(4-methylpentoxy)-diphenylsilane is sourced from PubChem (CID 91740897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).