(4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane

C17H34OSi — CID 12829136

IUPAC(4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane
SMILESCCCCC=C=C(C(CC(C)C)OCC)[Si](C)(C)C
InChIInChI=1S/C17H34OSi/c1-8-10-11-12-13-17(19(5,6)7)16(18-9-2)14-15(3)4/h12,15-16H,8-11,14H2,1-7H3
InChIKeyXECJTHCGTRMJOF-UHFFFAOYSA-N
MW282.54 g/mol
LogP5.59
Rot. Bonds9

About (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane

(4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane (PubChem CID 12829136) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane.

Molecular Properties

Compound Name(4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane
PubChem CID12829136
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Name(4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane
SMILESCCCCC=C=C(C(CC(C)C)OCC)[Si](C)(C)C
InChIInChI=1S/C17H34OSi/c1-8-10-11-12-13-17(19(5,6)7)16(18-9-2)14-15(3)4/h12,15-16H,8-11,14H2,1-7H3
InChIKeyXECJTHCGTRMJOF-UHFFFAOYSA-N
XLogP5.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 55.59
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'}

Analyze (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane with MolForge

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

Launch Full Analysis

Related Compounds

(5-Ethoxy-7-methylocta-2,3-dien-4-yl)-trimethylsilane
CID 12829125

Frequently Asked Questions

What is the IUPAC name of (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane?
The IUPAC name of (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane (CID 12829136) is (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane.
What is the SMILES notation for (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane?
The canonical SMILES for (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane is CCCCC=C=C(C(CC(C)C)OCC)[Si](C)(C)C.
What is the InChIKey of (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane?
The InChIKey is XECJTHCGTRMJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34OSi/c1-8-10-11-12-13-17(19(5,6)7)16(18-9-2)14-15(3)4/h12,15-16H,8-11,14H2,1-7H3.
What are the key properties of (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane?
(4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane has a molecular weight of 282.54 g/mol, XLogP of 5.59, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxy-2-methylundeca-5,6-dien-5-yl)-trimethylsilane is sourced from PubChem (CID 12829136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).