tributyl(2-trimethylstannylethynyl)stannane

C17H36Sn2 — CID 13118908

IUPACtributyl(2-trimethylstannylethynyl)stannane
SMILESCCCC[Sn](C#C[Sn](C)(C)C)(CCCC)CCCC
InChIInChI=1S/3C4H9.C2.3CH3.2Sn/c3*1-3-4-2;1-2;;;;;/h3*1,3-4H2,2H3;;3*1H3;;
InChIKeyMQJRQGUEWBGIAY-UHFFFAOYSA-N
MW477.90 g/mol
LogP6.26
Rot. Bonds9

About tributyl(2-trimethylstannylethynyl)stannane

tributyl(2-trimethylstannylethynyl)stannane (PubChem CID 13118908) has the molecular formula C17H36Sn2 and a molecular weight of 477.90 g/mol. Its IUPAC name is tributyl(2-trimethylstannylethynyl)stannane.

Molecular Properties

Compound Nametributyl(2-trimethylstannylethynyl)stannane
PubChem CID13118908
Molecular FormulaC17H36Sn2
Molecular Weight477.90 g/mol
Exact Mass480.09
IUPAC Nametributyl(2-trimethylstannylethynyl)stannane
SMILESCCCC[Sn](C#C[Sn](C)(C)C)(CCCC)CCCC
InChIInChI=1S/3C4H9.C2.3CH3.2Sn/c3*1-3-4-2;1-2;;;;;/h3*1,3-4H2,2H3;;3*1H3;;
InChIKeyMQJRQGUEWBGIAY-UHFFFAOYSA-N
XLogP6.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.90
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze tributyl(2-trimethylstannylethynyl)stannane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Bis(tributyltin) oxide
CID 16682746
Tetrabutyltin
CID 15098
Bis(tripropyltin) oxide
CID 16682947
Hexabutyldistannane
CID 6327815
Tributyltin sulfide
CID 16682974
Bis(tributylstannyl)acetylene
CID 305981
Stannane, tributylethyl-
CID 88048
Tetrapentyltin
CID 96902
Stannane, tributylpentyl-
CID 157238
Dibutyldipentyltin
CID 157239
Butyltripentyltin
CID 157240
Stannane, tetrakis(1-methylpropyl)-
CID 138645

Frequently Asked Questions

What is the IUPAC name of tributyl(2-trimethylstannylethynyl)stannane?
The IUPAC name of tributyl(2-trimethylstannylethynyl)stannane (CID 13118908) is tributyl(2-trimethylstannylethynyl)stannane.
What is the SMILES notation for tributyl(2-trimethylstannylethynyl)stannane?
The canonical SMILES for tributyl(2-trimethylstannylethynyl)stannane is CCCC[Sn](C#C[Sn](C)(C)C)(CCCC)CCCC.
What is the InChIKey of tributyl(2-trimethylstannylethynyl)stannane?
The InChIKey is MQJRQGUEWBGIAY-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H9.C2.3CH3.2Sn/c3*1-3-4-2;1-2;;;;;/h3*1,3-4H2,2H3;;3*1H3;;.
What are the key properties of tributyl(2-trimethylstannylethynyl)stannane?
tributyl(2-trimethylstannylethynyl)stannane has a molecular weight of 477.90 g/mol, XLogP of 6.26, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(2-trimethylstannylethynyl)stannane is sourced from PubChem (CID 13118908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).