tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane

C23H48OSiSn — CID 10719758

IUPACtert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane
SMILESCCCC[Sn](C#CCCCO[Si](C)(C)C(C)(C)C)(CCCC)CCCC
InChIInChI=1S/C11H21OSi.3C4H9.Sn/c1-7-8-9-10-12-13(5,6)11(2,3)4;3*1-3-4-2;/h8-10H2,2-6H3;3*1,3-4H2,2H3;
InChIKeyHMCBYLAMZSEAMX-UHFFFAOYSA-N
MW487.43 g/mol
LogP8.18
Rot. Bonds13

About tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane

tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane (PubChem CID 10719758) has the molecular formula C23H48OSiSn and a molecular weight of 487.43 g/mol. Its IUPAC name is tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane
PubChem CID10719758
Molecular FormulaC23H48OSiSn
Molecular Weight487.43 g/mol
Exact Mass488.25
IUPAC Nametert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane
SMILESCCCC[Sn](C#CCCCO[Si](C)(C)C(C)(C)C)(CCCC)CCCC
InChIInChI=1S/C11H21OSi.3C4H9.Sn/c1-7-8-9-10-12-13(5,6)11(2,3)4;3*1-3-4-2;/h8-10H2,2-6H3;3*1,3-4H2,2H3;
InChIKeyHMCBYLAMZSEAMX-UHFFFAOYSA-N
XLogP8.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.43
LogP ≤ 58.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane (CID 10719758) is tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane is CCCC[Sn](C#CCCCO[Si](C)(C)C(C)(C)C)(CCCC)CCCC.
What is the InChIKey of tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane?
The InChIKey is HMCBYLAMZSEAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21OSi.3C4H9.Sn/c1-7-8-9-10-12-13(5,6)11(2,3)4;3*1-3-4-2;/h8-10H2,2-6H3;3*1,3-4H2,2H3;.
What are the key properties of tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane?
tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane has a molecular weight of 487.43 g/mol, XLogP of 8.18, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(5-tributylstannylpent-4-ynoxy)silane is sourced from PubChem (CID 10719758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).