[9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane

C23H52O4Si2 — CID 20716716

IUPAC[9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane
SMILESCO[Si](C)(CC(C)(C)CC(C)(C)CC(C)(C)CC(C)(C)C[Si](C)(OC)OC)OC
InChIInChI=1S/C23H52O4Si2/c1-20(2,16-22(5,6)18-28(13,24-9)25-10)15-21(3,4)17-23(7,8)19-29(14,26-11)27-12/h15-19H2,1-14H3
InChIKeyYTUUALPVJYKTRS-UHFFFAOYSA-N
MW448.84 g/mol
LogP6.99
Rot. Bonds14

About [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane

[9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane (PubChem CID 20716716) has the molecular formula C23H52O4Si2 and a molecular weight of 448.84 g/mol. Its IUPAC name is [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane.

Molecular Properties

Compound Name[9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane
PubChem CID20716716
Molecular FormulaC23H52O4Si2
Molecular Weight448.84 g/mol
Exact Mass448.34
IUPAC Name[9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane
SMILESCO[Si](C)(CC(C)(C)CC(C)(C)CC(C)(C)CC(C)(C)C[Si](C)(OC)OC)OC
InChIInChI=1S/C23H52O4Si2/c1-20(2,16-22(5,6)18-28(13,24-9)25-10)15-21(3,4)17-23(7,8)19-29(14,26-11)27-12/h15-19H2,1-14H3
InChIKeyYTUUALPVJYKTRS-UHFFFAOYSA-N
XLogP6.99
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.84
LogP ≤ 56.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane?
The IUPAC name of [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane (CID 20716716) is [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane.
What is the SMILES notation for [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane?
The canonical SMILES for [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane is CO[Si](C)(CC(C)(C)CC(C)(C)CC(C)(C)CC(C)(C)C[Si](C)(OC)OC)OC.
What is the InChIKey of [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane?
The InChIKey is YTUUALPVJYKTRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H52O4Si2/c1-20(2,16-22(5,6)18-28(13,24-9)25-10)15-21(3,4)17-23(7,8)19-29(14,26-11)27-12/h15-19H2,1-14H3.
What are the key properties of [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane?
[9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane has a molecular weight of 448.84 g/mol, XLogP of 6.99, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [9-[dimethoxy(methyl)silyl]-2,2,4,4,6,6,8,8-octamethylnonyl]-dimethoxy-methylsilane is sourced from PubChem (CID 20716716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).