trimethyl(oct-1-ynoxy)silane

C11H22OSi — CID 88516583

IUPACtrimethyl(oct-1-ynoxy)silane
SMILESCCCCCCC#CO[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-5-6-7-8-9-10-11-12-13(2,3)4/h5-9H2,1-4H3
InChIKeyAVRXWOAOJRUBRX-UHFFFAOYSA-N
MW198.38 g/mol
LogP3.77
Rot. Bonds5

About trimethyl(oct-1-ynoxy)silane

trimethyl(oct-1-ynoxy)silane (PubChem CID 88516583) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is trimethyl(oct-1-ynoxy)silane.

Molecular Properties

Compound Nametrimethyl(oct-1-ynoxy)silane
PubChem CID88516583
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Nametrimethyl(oct-1-ynoxy)silane
SMILESCCCCCCC#CO[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-5-6-7-8-9-10-11-12-13(2,3)4/h5-9H2,1-4H3
InChIKeyAVRXWOAOJRUBRX-UHFFFAOYSA-N
XLogP3.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.77
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': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl(oct-1-ynoxy)silane?
The IUPAC name of trimethyl(oct-1-ynoxy)silane (CID 88516583) is trimethyl(oct-1-ynoxy)silane.
What is the SMILES notation for trimethyl(oct-1-ynoxy)silane?
The canonical SMILES for trimethyl(oct-1-ynoxy)silane is CCCCCCC#CO[Si](C)(C)C.
What is the InChIKey of trimethyl(oct-1-ynoxy)silane?
The InChIKey is AVRXWOAOJRUBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-5-6-7-8-9-10-11-12-13(2,3)4/h5-9H2,1-4H3.
What are the key properties of trimethyl(oct-1-ynoxy)silane?
trimethyl(oct-1-ynoxy)silane has a molecular weight of 198.38 g/mol, XLogP of 3.77, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(oct-1-ynoxy)silane is sourced from PubChem (CID 88516583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).