trimethoxy(pent-4-ynyl)silane

C8H16O3Si — CID 59533713

IUPACtrimethoxy(pent-4-ynyl)silane
SMILESC#CCCC[Si](OC)(OC)OC
InChIInChI=1S/C8H16O3Si/c1-5-6-7-8-12(9-2,10-3)11-4/h1H,6-8H2,2-4H3
InChIKeyDYSPMRVVWTULCH-UHFFFAOYSA-N
MW188.30 g/mol
LogP1.28
Rot. Bonds6

About trimethoxy(pent-4-ynyl)silane

trimethoxy(pent-4-ynyl)silane (PubChem CID 59533713) has the molecular formula C8H16O3Si and a molecular weight of 188.30 g/mol. Its IUPAC name is trimethoxy(pent-4-ynyl)silane.

Molecular Properties

Compound Nametrimethoxy(pent-4-ynyl)silane
PubChem CID59533713
Molecular FormulaC8H16O3Si
Molecular Weight188.30 g/mol
Exact Mass188.09
IUPAC Nametrimethoxy(pent-4-ynyl)silane
SMILESC#CCCC[Si](OC)(OC)OC
InChIInChI=1S/C8H16O3Si/c1-5-6-7-8-12(9-2,10-3)11-4/h1H,6-8H2,2-4H3
InChIKeyDYSPMRVVWTULCH-UHFFFAOYSA-N
XLogP1.28
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 trimethoxy(pent-4-ynyl)silane?
The IUPAC name of trimethoxy(pent-4-ynyl)silane (CID 59533713) is trimethoxy(pent-4-ynyl)silane.
What is the SMILES notation for trimethoxy(pent-4-ynyl)silane?
The canonical SMILES for trimethoxy(pent-4-ynyl)silane is C#CCCC[Si](OC)(OC)OC.
What is the InChIKey of trimethoxy(pent-4-ynyl)silane?
The InChIKey is DYSPMRVVWTULCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3Si/c1-5-6-7-8-12(9-2,10-3)11-4/h1H,6-8H2,2-4H3.
What are the key properties of trimethoxy(pent-4-ynyl)silane?
trimethoxy(pent-4-ynyl)silane has a molecular weight of 188.30 g/mol, XLogP of 1.28, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(pent-4-ynyl)silane is sourced from PubChem (CID 59533713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).