2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane

C17H40OSi2 — CID 58067941

IUPAC2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane
SMILESCCCC(CC)C[Si](C)(C)O[Si](C)(C)CC(CC)CC
InChIInChI=1S/C17H40OSi2/c1-9-13-17(12-4)15-20(7,8)18-19(5,6)14-16(10-2)11-3/h16-17H,9-15H2,1-8H3
InChIKeyDAFDAYAJRYNQME-UHFFFAOYSA-N
MW316.68 g/mol
LogP6.68
Rot. Bonds11

About 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane

2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane (PubChem CID 58067941) has the molecular formula C17H40OSi2 and a molecular weight of 316.68 g/mol. Its IUPAC name is 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Name2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane
PubChem CID58067941
Molecular FormulaC17H40OSi2
Molecular Weight316.68 g/mol
Exact Mass316.26
IUPAC Name2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane
SMILESCCCC(CC)C[Si](C)(C)O[Si](C)(C)CC(CC)CC
InChIInChI=1S/C17H40OSi2/c1-9-13-17(12-4)15-20(7,8)18-19(5,6)14-16(10-2)11-3/h16-17H,9-15H2,1-8H3
InChIKeyDAFDAYAJRYNQME-UHFFFAOYSA-N
XLogP6.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.68
LogP ≤ 56.68
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 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane?
The IUPAC name of 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane (CID 58067941) is 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane.
What is the SMILES notation for 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane?
The canonical SMILES for 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane is CCCC(CC)C[Si](C)(C)O[Si](C)(C)CC(CC)CC.
What is the InChIKey of 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane?
The InChIKey is DAFDAYAJRYNQME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H40OSi2/c1-9-13-17(12-4)15-20(7,8)18-19(5,6)14-16(10-2)11-3/h16-17H,9-15H2,1-8H3.
What are the key properties of 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane?
2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane has a molecular weight of 316.68 g/mol, XLogP of 6.68, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylbutyl-[2-ethylpentyl(dimethyl)silyl]oxy-dimethylsilane is sourced from PubChem (CID 58067941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).