trimethyl(oct-7-en-2-ynoxy)silane

C11H20OSi — CID 53493819

IUPACtrimethyl(oct-7-en-2-ynoxy)silane
SMILESC=CCCCC#CCO[Si](C)(C)C
InChIInChI=1S/C11H20OSi/c1-5-6-7-8-9-10-11-12-13(2,3)4/h5H,1,6-8,11H2,2-4H3
InChIKeyJPVBRNSUTDSBQY-UHFFFAOYSA-N
MW196.37 g/mol
LogP3.20
Rot. Bonds5

About trimethyl(oct-7-en-2-ynoxy)silane

trimethyl(oct-7-en-2-ynoxy)silane (PubChem CID 53493819) has the molecular formula C11H20OSi and a molecular weight of 196.37 g/mol. Its IUPAC name is trimethyl(oct-7-en-2-ynoxy)silane.

Molecular Properties

Compound Nametrimethyl(oct-7-en-2-ynoxy)silane
PubChem CID53493819
Molecular FormulaC11H20OSi
Molecular Weight196.37 g/mol
Exact Mass196.13
IUPAC Nametrimethyl(oct-7-en-2-ynoxy)silane
SMILESC=CCCCC#CCO[Si](C)(C)C
InChIInChI=1S/C11H20OSi/c1-5-6-7-8-9-10-11-12-13(2,3)4/h5H,1,6-8,11H2,2-4H3
InChIKeyJPVBRNSUTDSBQY-UHFFFAOYSA-N
XLogP3.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.37
LogP ≤ 53.20
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl(oct-7-en-2-ynoxy)silane?
The IUPAC name of trimethyl(oct-7-en-2-ynoxy)silane (CID 53493819) is trimethyl(oct-7-en-2-ynoxy)silane.
What is the SMILES notation for trimethyl(oct-7-en-2-ynoxy)silane?
The canonical SMILES for trimethyl(oct-7-en-2-ynoxy)silane is C=CCCCC#CCO[Si](C)(C)C.
What is the InChIKey of trimethyl(oct-7-en-2-ynoxy)silane?
The InChIKey is JPVBRNSUTDSBQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20OSi/c1-5-6-7-8-9-10-11-12-13(2,3)4/h5H,1,6-8,11H2,2-4H3.
What are the key properties of trimethyl(oct-7-en-2-ynoxy)silane?
trimethyl(oct-7-en-2-ynoxy)silane has a molecular weight of 196.37 g/mol, XLogP of 3.20, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(oct-7-en-2-ynoxy)silane is sourced from PubChem (CID 53493819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).