[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane

C19H42O2Si — CID 86080089

IUPAC[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane
SMILESCCOCC(CO[Si](CC)(CC)CC)(CC(C)C)CC(C)C
InChIInChI=1S/C19H42O2Si/c1-9-20-15-19(13-17(5)6,14-18(7)8)16-21-22(10-2,11-3)12-4/h17-18H,9-16H2,1-8H3
InChIKeyYWOZUJONCPNURT-UHFFFAOYSA-N
MW330.63 g/mol
LogP6.12
Rot. Bonds13

About [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane

[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane (PubChem CID 86080089) has the molecular formula C19H42O2Si and a molecular weight of 330.63 g/mol. Its IUPAC name is [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane.

Molecular Properties

Compound Name[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane
PubChem CID86080089
Molecular FormulaC19H42O2Si
Molecular Weight330.63 g/mol
Exact Mass330.30
IUPAC Name[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane
SMILESCCOCC(CO[Si](CC)(CC)CC)(CC(C)C)CC(C)C
InChIInChI=1S/C19H42O2Si/c1-9-20-15-19(13-17(5)6,14-18(7)8)16-21-22(10-2,11-3)12-4/h17-18H,9-16H2,1-8H3
InChIKeyYWOZUJONCPNURT-UHFFFAOYSA-N
XLogP6.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.63
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Butan-2-yl-diethoxy-(2,4,4,6,6-pentamethylheptyl)silane
CID 19076221
Tert-butyl-diethoxy-(2,4,4,6,6-pentamethylheptyl)silane
CID 19076222
Diethoxy-(2-methylpropyl)-(2,4,4,6,6-pentamethylheptyl)silane
CID 19076223
Diethoxy-(2,4,4,6,6-pentamethylheptyl)-propan-2-ylsilane
CID 19076226
4,4-Bis(butoxymethyl)-2,6-dimethylheptane
CID 22020667
4,4-Bis(methoxymethyl)-2,6-dimethylheptane;ethoxyethane
CID 23173092
Tert-butyl-dimethyl-[3-(15-methylhexadecoxy)propoxy]silane
CID 59379100
2,2-Di-n-butyl-1-methoxy-3-[(tert-butyidimethylsilyl)oxy]-propane
CID 86248050
2,2-Di-n-butyl-1-methoxy-3-[(triethylsilyl)oxy]propane
CID 86248051
2,2-Di-n-propyl-1-methoxy-3-[(trimethylsilyl)oxy]-propane
CID 86248054
[2-Butyl-2-(methoxymethyl)hexoxy]-dimethyl-propylsilane
CID 86248067
Butyl-[2-butyl-2-(methoxymethyl)hexoxy]-dimethylsilane
CID 86248068

Frequently Asked Questions

What is the IUPAC name of [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane?
The IUPAC name of [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane (CID 86080089) is [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane.
What is the SMILES notation for [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane?
The canonical SMILES for [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane is CCOCC(CO[Si](CC)(CC)CC)(CC(C)C)CC(C)C.
What is the InChIKey of [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane?
The InChIKey is YWOZUJONCPNURT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H42O2Si/c1-9-20-15-19(13-17(5)6,14-18(7)8)16-21-22(10-2,11-3)12-4/h17-18H,9-16H2,1-8H3.
What are the key properties of [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane?
[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane has a molecular weight of 330.63 g/mol, XLogP of 6.12, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-triethylsilane is sourced from PubChem (CID 86080089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).