trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane

C18H36O2Si — CID 23649958

IUPACtrimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane
SMILESC=CCCCCCCC/C=C(\OC(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H36O2Si/c1-8-9-10-11-12-13-14-15-16-17(19-18(2,3)4)20-21(5,6)7/h8,16H,1,9-15H2,2-7H3/b17-16+
InChIKeyRDCIMBPVOVPUIE-WUKNDPDISA-N
MW312.57 g/mol
LogP6.41
Rot. Bonds11

About trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane

trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane (PubChem CID 23649958) has the molecular formula C18H36O2Si and a molecular weight of 312.57 g/mol. Its IUPAC name is trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane.

Molecular Properties

Compound Nametrimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane
PubChem CID23649958
Molecular FormulaC18H36O2Si
Molecular Weight312.57 g/mol
Exact Mass312.25
IUPAC Nametrimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane
SMILESC=CCCCCCCC/C=C(\OC(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C18H36O2Si/c1-8-9-10-11-12-13-14-15-16-17(19-18(2,3)4)20-21(5,6)7/h8,16H,1,9-15H2,2-7H3/b17-16+
InChIKeyRDCIMBPVOVPUIE-WUKNDPDISA-N
XLogP6.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.57
LogP ≤ 56.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane?
The IUPAC name of trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane (CID 23649958) is trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane.
What is the SMILES notation for trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane?
The canonical SMILES for trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane is C=CCCCCCCC/C=C(\OC(C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane?
The InChIKey is RDCIMBPVOVPUIE-WUKNDPDISA-N. The full InChI is InChI=1S/C18H36O2Si/c1-8-9-10-11-12-13-14-15-16-17(19-18(2,3)4)20-21(5,6)7/h8,16H,1,9-15H2,2-7H3/b17-16+.
What are the key properties of trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane?
trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane has a molecular weight of 312.57 g/mol, XLogP of 6.41, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(1E)-1-[(2-methylpropan-2-yl)oxy]undeca-1,10-dienoxy]silane is sourced from PubChem (CID 23649958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).