trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane

C26H26Si2 — CID 10949276

IUPACtrimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane
SMILESC[Si](C)(C)C#Cc1ccc(C#C[Si](C)(C)C)c2c1-c1cccc3cccc-2c13
InChIInChI=1S/C26H26Si2/c1-27(2,3)17-15-20-13-14-21(16-18-28(4,5)6)26-23-12-8-10-19-9-7-11-22(24(19)23)25(20)26/h7-14H,1-6H3
InChIKeyUFMSTBMTGFSIAD-UHFFFAOYSA-N
MW394.67 g/mol
LogP6.95
Rot. Bonds

About trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane

trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane (PubChem CID 10949276) has the molecular formula C26H26Si2 and a molecular weight of 394.67 g/mol. Its IUPAC name is trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane
PubChem CID10949276
Molecular FormulaC26H26Si2
Molecular Weight394.67 g/mol
Exact Mass394.16
IUPAC Nametrimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane
SMILESC[Si](C)(C)C#Cc1ccc(C#C[Si](C)(C)C)c2c1-c1cccc3cccc-2c13
InChIInChI=1S/C26H26Si2/c1-27(2,3)17-15-20-13-14-21(16-18-28(4,5)6)26-23-12-8-10-19-9-7-11-22(24(19)23)25(20)26/h7-14H,1-6H3
InChIKeyUFMSTBMTGFSIAD-UHFFFAOYSA-N
XLogP6.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.67
LogP ≤ 56.95
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 trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane?
The IUPAC name of trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane (CID 10949276) is trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane.
What is the SMILES notation for trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane?
The canonical SMILES for trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane is C[Si](C)(C)C#Cc1ccc(C#C[Si](C)(C)C)c2c1-c1cccc3cccc-2c13.
What is the InChIKey of trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane?
The InChIKey is UFMSTBMTGFSIAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26Si2/c1-27(2,3)17-15-20-13-14-21(16-18-28(4,5)6)26-23-12-8-10-19-9-7-11-22(24(19)23)25(20)26/h7-14H,1-6H3.
What are the key properties of trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane?
trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane has a molecular weight of 394.67 g/mol, XLogP of 6.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[10-(2-trimethylsilylethynyl)fluoranthen-7-yl]ethynyl]silane is sourced from PubChem (CID 10949276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).