dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane

C24H20Si — CID 15981524

IUPACdimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane
SMILESC[Si](C)(C#Cc1ccccc1)c1ccccc1C#Cc1ccccc1
InChIInChI=1S/C24H20Si/c1-25(2,20-19-22-13-7-4-8-14-22)24-16-10-9-15-23(24)18-17-21-11-5-3-6-12-21/h3-16H,1-2H3
InChIKeyDMKKVSGFGAGPCI-UHFFFAOYSA-N
MW336.51 g/mol
LogP4.59
Rot. Bonds1

About dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane

dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane (PubChem CID 15981524) has the molecular formula C24H20Si and a molecular weight of 336.51 g/mol. Its IUPAC name is dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane.

Molecular Properties

Compound Namedimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane
PubChem CID15981524
Molecular FormulaC24H20Si
Molecular Weight336.51 g/mol
Exact Mass336.13
IUPAC Namedimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane
SMILESC[Si](C)(C#Cc1ccccc1)c1ccccc1C#Cc1ccccc1
InChIInChI=1S/C24H20Si/c1-25(2,20-19-22-13-7-4-8-14-22)24-16-10-9-15-23(24)18-17-21-11-5-3-6-12-21/h3-16H,1-2H3
InChIKeyDMKKVSGFGAGPCI-UHFFFAOYSA-N
XLogP4.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.51
LogP ≤ 54.59
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 dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane?
The IUPAC name of dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane (CID 15981524) is dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane.
What is the SMILES notation for dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane?
The canonical SMILES for dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane is C[Si](C)(C#Cc1ccccc1)c1ccccc1C#Cc1ccccc1.
What is the InChIKey of dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane?
The InChIKey is DMKKVSGFGAGPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20Si/c1-25(2,20-19-22-13-7-4-8-14-22)24-16-10-9-15-23(24)18-17-21-11-5-3-6-12-21/h3-16H,1-2H3.
What are the key properties of dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane?
dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane has a molecular weight of 336.51 g/mol, XLogP of 4.59, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(2-phenylethynyl)-[2-(2-phenylethynyl)phenyl]silane is sourced from PubChem (CID 15981524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).