dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane

C18H38OSi — CID 5353190

IUPACdimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane
SMILESCCCC/C=C/C(C)O[Si](C)(C)CCCCCCCC
InChIInChI=1S/C18H38OSi/c1-6-8-10-12-13-15-17-20(4,5)19-18(3)16-14-11-9-7-2/h14,16,18H,6-13,15,17H2,1-5H3/b16-14+
InChIKeyGZUNSJGDFQGXKJ-JQIJEIRASA-N
MW298.59 g/mol
LogP6.70
Rot. Bonds13

About dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane

dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane (PubChem CID 5353190) has the molecular formula C18H38OSi and a molecular weight of 298.59 g/mol. Its IUPAC name is dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane.

Molecular Properties

Compound Namedimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane
PubChem CID5353190
Molecular FormulaC18H38OSi
Molecular Weight298.59 g/mol
Exact Mass298.27
IUPAC Namedimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane
SMILESCCCC/C=C/C(C)O[Si](C)(C)CCCCCCCC
InChIInChI=1S/C18H38OSi/c1-6-8-10-12-13-15-17-20(4,5)19-18(3)16-14-11-9-7-2/h14,16,18H,6-13,15,17H2,1-5H3/b16-14+
InChIKeyGZUNSJGDFQGXKJ-JQIJEIRASA-N
XLogP6.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.59
LogP ≤ 56.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane?
The IUPAC name of dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane (CID 5353190) is dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane.
What is the SMILES notation for dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane?
The canonical SMILES for dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane is CCCC/C=C/C(C)O[Si](C)(C)CCCCCCCC.
What is the InChIKey of dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane?
The InChIKey is GZUNSJGDFQGXKJ-JQIJEIRASA-N. The full InChI is InChI=1S/C18H38OSi/c1-6-8-10-12-13-15-17-20(4,5)19-18(3)16-14-11-9-7-2/h14,16,18H,6-13,15,17H2,1-5H3/b16-14+.
What are the key properties of dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane?
dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane has a molecular weight of 298.59 g/mol, XLogP of 6.70, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(E)-oct-3-en-2-yl]oxy-octylsilane is sourced from PubChem (CID 5353190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).