trimethyl-[2-(oxiran-2-yl)ethynyl]silane

C7H12OSi — CID 45079317

IUPACtrimethyl-[2-(oxiran-2-yl)ethynyl]silane
SMILESC[Si](C)(C)C#CC1CO1
InChIInChI=1S/C7H12OSi/c1-9(2,3)5-4-7-6-8-7/h7H,6H2,1-3H3
InChIKeyCXWSQXDQXKZMBJ-UHFFFAOYSA-N
MW140.26 g/mol
LogP1.27
Rot. Bonds

About trimethyl-[2-(oxiran-2-yl)ethynyl]silane

trimethyl-[2-(oxiran-2-yl)ethynyl]silane (PubChem CID 45079317) has the molecular formula C7H12OSi and a molecular weight of 140.26 g/mol. Its IUPAC name is trimethyl-[2-(oxiran-2-yl)ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(oxiran-2-yl)ethynyl]silane
PubChem CID45079317
Molecular FormulaC7H12OSi
Molecular Weight140.26 g/mol
Exact Mass140.07
IUPAC Nametrimethyl-[2-(oxiran-2-yl)ethynyl]silane
SMILESC[Si](C)(C)C#CC1CO1
InChIInChI=1S/C7H12OSi/c1-9(2,3)5-4-7-6-8-7/h7H,6H2,1-3H3
InChIKeyCXWSQXDQXKZMBJ-UHFFFAOYSA-N
XLogP1.27
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.26
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-(oxiran-2-yl)ethynyl]silane?
The IUPAC name of trimethyl-[2-(oxiran-2-yl)ethynyl]silane (CID 45079317) is trimethyl-[2-(oxiran-2-yl)ethynyl]silane.
What is the SMILES notation for trimethyl-[2-(oxiran-2-yl)ethynyl]silane?
The canonical SMILES for trimethyl-[2-(oxiran-2-yl)ethynyl]silane is C[Si](C)(C)C#CC1CO1.
What is the InChIKey of trimethyl-[2-(oxiran-2-yl)ethynyl]silane?
The InChIKey is CXWSQXDQXKZMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12OSi/c1-9(2,3)5-4-7-6-8-7/h7H,6H2,1-3H3.
What are the key properties of trimethyl-[2-(oxiran-2-yl)ethynyl]silane?
trimethyl-[2-(oxiran-2-yl)ethynyl]silane has a molecular weight of 140.26 g/mol, XLogP of 1.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(oxiran-2-yl)ethynyl]silane is sourced from PubChem (CID 45079317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).