[4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane

C18H42OSi2 — CID 123839299

IUPAC[4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane
SMILESCCC(C)(C)CC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)CC
InChIInChI=1S/C18H42OSi2/c1-12-17(3,4)14-16(18(5,6)13-2)15-21(10,11)19-20(7,8)9/h16H,12-15H2,1-11H3
InChIKeyQLMGREWJAWXCAX-UHFFFAOYSA-N
MW330.71 g/mol
LogP6.92
Rot. Bonds9

About [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane

[4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane (PubChem CID 123839299) has the molecular formula C18H42OSi2 and a molecular weight of 330.71 g/mol. Its IUPAC name is [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane.

Molecular Properties

Compound Name[4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane
PubChem CID123839299
Molecular FormulaC18H42OSi2
Molecular Weight330.71 g/mol
Exact Mass330.28
IUPAC Name[4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane
SMILESCCC(C)(C)CC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)CC
InChIInChI=1S/C18H42OSi2/c1-12-17(3,4)14-16(18(5,6)13-2)15-21(10,11)19-20(7,8)9/h16H,12-15H2,1-11H3
InChIKeyQLMGREWJAWXCAX-UHFFFAOYSA-N
XLogP6.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.71
LogP ≤ 56.92
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 [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane?
The IUPAC name of [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane (CID 123839299) is [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane.
What is the SMILES notation for [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane?
The canonical SMILES for [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane is CCC(C)(C)CC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)CC.
What is the InChIKey of [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane?
The InChIKey is QLMGREWJAWXCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42OSi2/c1-12-17(3,4)14-16(18(5,6)13-2)15-21(10,11)19-20(7,8)9/h16H,12-15H2,1-11H3.
What are the key properties of [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane?
[4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane has a molecular weight of 330.71 g/mol, XLogP of 6.92, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4,4-dimethyl-2-(2-methylbutan-2-yl)hexyl]-dimethyl-trimethylsilyloxysilane is sourced from PubChem (CID 123839299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).