[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane

C17H38O2Si — CID 87774442

IUPAC[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane
SMILESCCOCC(CO[Si](C)(C)CC)(CC(C)C)CC(C)C
InChIInChI=1S/C17H38O2Si/c1-9-18-13-17(11-15(3)4,12-16(5)6)14-19-20(7,8)10-2/h15-16H,9-14H2,1-8H3
InChIKeyLZIFYTQMGHTDMS-UHFFFAOYSA-N
MW302.58 g/mol
LogP5.34
Rot. Bonds11

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

[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane (PubChem CID 87774442) has the molecular formula C17H38O2Si and a molecular weight of 302.58 g/mol. Its IUPAC name is [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane.

Molecular Properties

Compound Name[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane
PubChem CID87774442
Molecular FormulaC17H38O2Si
Molecular Weight302.58 g/mol
Exact Mass302.26
IUPAC Name[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane
SMILESCCOCC(CO[Si](C)(C)CC)(CC(C)C)CC(C)C
InChIInChI=1S/C17H38O2Si/c1-9-18-13-17(11-15(3)4,12-16(5)6)14-19-20(7,8)10-2/h15-16H,9-14H2,1-8H3
InChIKeyLZIFYTQMGHTDMS-UHFFFAOYSA-N
XLogP5.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.58
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane?
The IUPAC name of [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane (CID 87774442) is [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane.
What is the SMILES notation for [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane?
The canonical SMILES for [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane is CCOCC(CO[Si](C)(C)CC)(CC(C)C)CC(C)C.
What is the InChIKey of [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane?
The InChIKey is LZIFYTQMGHTDMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38O2Si/c1-9-18-13-17(11-15(3)4,12-16(5)6)14-19-20(7,8)10-2/h15-16H,9-14H2,1-8H3.
What are the key properties of [2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane?
[2-(ethoxymethyl)-4-methyl-2-(2-methylpropyl)pentoxy]-ethyl-dimethylsilane has a molecular weight of 302.58 g/mol, XLogP of 5.34, 11 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]-ethyl-dimethylsilane is sourced from PubChem (CID 87774442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).