2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane

C13H20Si2 — CID 71381536

IUPAC2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane
SMILESC[SiH](C)c1ccc(C#C[Si](C)(C)C)cc1
InChIInChI=1S/C13H20Si2/c1-14(2)13-8-6-12(7-9-13)10-11-15(3,4)5/h6-9,14H,1-5H3
InChIKeyVXMRIZWPPODHQP-UHFFFAOYSA-N
MW232.47 g/mol
LogP2.61
Rot. Bonds1

About 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane

2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane (PubChem CID 71381536) has the molecular formula C13H20Si2 and a molecular weight of 232.47 g/mol. Its IUPAC name is 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane.

Molecular Properties

Compound Name2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane
PubChem CID71381536
Molecular FormulaC13H20Si2
Molecular Weight232.47 g/mol
Exact Mass232.11
IUPAC Name2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane
SMILESC[SiH](C)c1ccc(C#C[Si](C)(C)C)cc1
InChIInChI=1S/C13H20Si2/c1-14(2)13-8-6-12(7-9-13)10-11-15(3,4)5/h6-9,14H,1-5H3
InChIKeyVXMRIZWPPODHQP-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.47
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane?
The IUPAC name of 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane (CID 71381536) is 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane.
What is the SMILES notation for 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane?
The canonical SMILES for 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane is C[SiH](C)c1ccc(C#C[Si](C)(C)C)cc1.
What is the InChIKey of 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane?
The InChIKey is VXMRIZWPPODHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20Si2/c1-14(2)13-8-6-12(7-9-13)10-11-15(3,4)5/h6-9,14H,1-5H3.
What are the key properties of 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane?
2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane has a molecular weight of 232.47 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-dimethylsilylphenyl)ethynyl-trimethylsilane is sourced from PubChem (CID 71381536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).