tributyl-(3-methylthiophen-2-yl)stannane

C17H32SSn — CID 15211846

IUPACtributyl-(3-methylthiophen-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1sccc1C
InChIInChI=1S/C5H5S.3C4H9.Sn/c1-5-2-3-6-4-5;3*1-3-4-2;/h2-3H,1H3;3*1,3-4H2,2H3;
InChIKeyMSKNSVGPYFVXHC-UHFFFAOYSA-N
MW387.22 g/mol
LogP6.11
Rot. Bonds10

About tributyl-(3-methylthiophen-2-yl)stannane

tributyl-(3-methylthiophen-2-yl)stannane (PubChem CID 15211846) has the molecular formula C17H32SSn and a molecular weight of 387.22 g/mol. Its IUPAC name is tributyl-(3-methylthiophen-2-yl)stannane.

Molecular Properties

Compound Nametributyl-(3-methylthiophen-2-yl)stannane
PubChem CID15211846
Molecular FormulaC17H32SSn
Molecular Weight387.22 g/mol
Exact Mass388.12
IUPAC Nametributyl-(3-methylthiophen-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1sccc1C
InChIInChI=1S/C5H5S.3C4H9.Sn/c1-5-2-3-6-4-5;3*1-3-4-2;/h2-3H,1H3;3*1,3-4H2,2H3;
InChIKeyMSKNSVGPYFVXHC-UHFFFAOYSA-N
XLogP6.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.22
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tributyl-(3-methylthiophen-2-yl)stannane?
The IUPAC name of tributyl-(3-methylthiophen-2-yl)stannane (CID 15211846) is tributyl-(3-methylthiophen-2-yl)stannane.
What is the SMILES notation for tributyl-(3-methylthiophen-2-yl)stannane?
The canonical SMILES for tributyl-(3-methylthiophen-2-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1sccc1C.
What is the InChIKey of tributyl-(3-methylthiophen-2-yl)stannane?
The InChIKey is MSKNSVGPYFVXHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5S.3C4H9.Sn/c1-5-2-3-6-4-5;3*1-3-4-2;/h2-3H,1H3;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(3-methylthiophen-2-yl)stannane?
tributyl-(3-methylthiophen-2-yl)stannane has a molecular weight of 387.22 g/mol, XLogP of 6.11, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(3-methylthiophen-2-yl)stannane is sourced from PubChem (CID 15211846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).