(2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane

C13H26OSi — CID 552672

IUPAC(2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane
SMILESC=CC(C)(CC=C(C)C)CO[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-8-13(4,10-9-12(2)3)11-14-15(5,6)7/h8-9H,1,10-11H2,2-7H3
InChIKeyVTSWOTJXCCKPFI-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.39
Rot. Bonds6

About (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane

(2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane (PubChem CID 552672) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane.

Molecular Properties

Compound Name(2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane
PubChem CID552672
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name(2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane
SMILESC=CC(C)(CC=C(C)C)CO[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-8-13(4,10-9-12(2)3)11-14-15(5,6)7/h8-9H,1,10-11H2,2-7H3
InChIKeyVTSWOTJXCCKPFI-UHFFFAOYSA-N
XLogP4.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane?
The IUPAC name of (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane (CID 552672) is (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane.
What is the SMILES notation for (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane?
The canonical SMILES for (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane is C=CC(C)(CC=C(C)C)CO[Si](C)(C)C.
What is the InChIKey of (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane?
The InChIKey is VTSWOTJXCCKPFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-8-13(4,10-9-12(2)3)11-14-15(5,6)7/h8-9H,1,10-11H2,2-7H3.
What are the key properties of (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane?
(2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.39, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenyl-2,5-dimethylhex-4-enoxy)-trimethylsilane is sourced from PubChem (CID 552672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).