trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane

C20H40SSiSn — CID 139715520

IUPACtrimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane
SMILESCCCC[Sn](CCCC)(CCCC)c1cc([Si](C)(C)C)sc1C
InChIInChI=1S/C8H13SSi.3C4H9.Sn/c1-7-5-6-8(9-7)10(2,3)4;3*1-3-4-2;/h6H,1-4H3;3*1,3-4H2,2H3;
InChIKeyJZWZEUDFXPXGFP-UHFFFAOYSA-N
MW459.40 g/mol
LogP6.66
Rot. Bonds11

About trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane

trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane (PubChem CID 139715520) has the molecular formula C20H40SSiSn and a molecular weight of 459.40 g/mol. Its IUPAC name is trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane.

Molecular Properties

Compound Nametrimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane
PubChem CID139715520
Molecular FormulaC20H40SSiSn
Molecular Weight459.40 g/mol
Exact Mass460.16
IUPAC Nametrimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane
SMILESCCCC[Sn](CCCC)(CCCC)c1cc([Si](C)(C)C)sc1C
InChIInChI=1S/C8H13SSi.3C4H9.Sn/c1-7-5-6-8(9-7)10(2,3)4;3*1-3-4-2;/h6H,1-4H3;3*1,3-4H2,2H3;
InChIKeyJZWZEUDFXPXGFP-UHFFFAOYSA-N
XLogP6.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500459.40
LogP ≤ 56.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane?
The IUPAC name of trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane (CID 139715520) is trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane.
What is the SMILES notation for trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane?
The canonical SMILES for trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane is CCCC[Sn](CCCC)(CCCC)c1cc([Si](C)(C)C)sc1C.
What is the InChIKey of trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane?
The InChIKey is JZWZEUDFXPXGFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13SSi.3C4H9.Sn/c1-7-5-6-8(9-7)10(2,3)4;3*1-3-4-2;/h6H,1-4H3;3*1,3-4H2,2H3;.
What are the key properties of trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane?
trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane has a molecular weight of 459.40 g/mol, XLogP of 6.66, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(5-methyl-4-tributylstannylthiophen-2-yl)silane is sourced from PubChem (CID 139715520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).