tributyl(3-methylbut-2-enyl)stannane

C17H36Sn — CID 2734722

IUPACtributyl(3-methylbut-2-enyl)stannane
SMILESCCCC[Sn](CC=C(C)C)(CCCC)CCCC
InChIInChI=1S/C5H9.3C4H9.Sn/c1-4-5(2)3;3*1-3-4-2;/h4H,1H2,2-3H3;3*1,3-4H2,2H3;
InChIKeyXEFRYQPTIWSVGI-UHFFFAOYSA-N
MW359.19 g/mol
LogP6.80
Rot. Bonds11

About tributyl(3-methylbut-2-enyl)stannane

tributyl(3-methylbut-2-enyl)stannane (PubChem CID 2734722) has the molecular formula C17H36Sn and a molecular weight of 359.19 g/mol. Its IUPAC name is tributyl(3-methylbut-2-enyl)stannane.

Molecular Properties

Compound Nametributyl(3-methylbut-2-enyl)stannane
PubChem CID2734722
Molecular FormulaC17H36Sn
Molecular Weight359.19 g/mol
Exact Mass360.18
IUPAC Nametributyl(3-methylbut-2-enyl)stannane
SMILESCCCC[Sn](CC=C(C)C)(CCCC)CCCC
InChIInChI=1S/C5H9.3C4H9.Sn/c1-4-5(2)3;3*1-3-4-2;/h4H,1H2,2-3H3;3*1,3-4H2,2H3;
InChIKeyXEFRYQPTIWSVGI-UHFFFAOYSA-N
XLogP6.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.19
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tributyl(3-methylbut-2-enyl)stannane?
The IUPAC name of tributyl(3-methylbut-2-enyl)stannane (CID 2734722) is tributyl(3-methylbut-2-enyl)stannane.
What is the SMILES notation for tributyl(3-methylbut-2-enyl)stannane?
The canonical SMILES for tributyl(3-methylbut-2-enyl)stannane is CCCC[Sn](CC=C(C)C)(CCCC)CCCC.
What is the InChIKey of tributyl(3-methylbut-2-enyl)stannane?
The InChIKey is XEFRYQPTIWSVGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9.3C4H9.Sn/c1-4-5(2)3;3*1-3-4-2;/h4H,1H2,2-3H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl(3-methylbut-2-enyl)stannane?
tributyl(3-methylbut-2-enyl)stannane has a molecular weight of 359.19 g/mol, XLogP of 6.80, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(3-methylbut-2-enyl)stannane is sourced from PubChem (CID 2734722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).