dibutyl-chloro-(2-ethoxyethyl)stannane

C12H27ClOSn — CID 15106091

IUPACdibutyl-chloro-(2-ethoxyethyl)stannane
SMILESCCCC[Sn](Cl)(CCCC)CCOCC
InChIInChI=1S/C4H9O.2C4H9.ClH.Sn/c1-3-5-4-2;2*1-3-4-2;;/h1,3-4H2,2H3;2*1,3-4H2,2H3;1H;/q;;;;+1/p-1
InChIKeyGOLOTTWLXQSQGM-UHFFFAOYSA-M
MW341.51 g/mol
LogP4.81
Rot. Bonds10

About dibutyl-chloro-(2-ethoxyethyl)stannane

dibutyl-chloro-(2-ethoxyethyl)stannane (PubChem CID 15106091) has the molecular formula C12H27ClOSn and a molecular weight of 341.51 g/mol. Its IUPAC name is dibutyl-chloro-(2-ethoxyethyl)stannane.

Molecular Properties

Compound Namedibutyl-chloro-(2-ethoxyethyl)stannane
PubChem CID15106091
Molecular FormulaC12H27ClOSn
Molecular Weight341.51 g/mol
Exact Mass342.08
IUPAC Namedibutyl-chloro-(2-ethoxyethyl)stannane
SMILESCCCC[Sn](Cl)(CCCC)CCOCC
InChIInChI=1S/C4H9O.2C4H9.ClH.Sn/c1-3-5-4-2;2*1-3-4-2;;/h1,3-4H2,2H3;2*1,3-4H2,2H3;1H;/q;;;;+1/p-1
InChIKeyGOLOTTWLXQSQGM-UHFFFAOYSA-M
XLogP4.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.51
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dibutyl-chloro-(2-ethoxyethyl)stannane?
The IUPAC name of dibutyl-chloro-(2-ethoxyethyl)stannane (CID 15106091) is dibutyl-chloro-(2-ethoxyethyl)stannane.
What is the SMILES notation for dibutyl-chloro-(2-ethoxyethyl)stannane?
The canonical SMILES for dibutyl-chloro-(2-ethoxyethyl)stannane is CCCC[Sn](Cl)(CCCC)CCOCC.
What is the InChIKey of dibutyl-chloro-(2-ethoxyethyl)stannane?
The InChIKey is GOLOTTWLXQSQGM-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9O.2C4H9.ClH.Sn/c1-3-5-4-2;2*1-3-4-2;;/h1,3-4H2,2H3;2*1,3-4H2,2H3;1H;/q;;;;+1/p-1.
What are the key properties of dibutyl-chloro-(2-ethoxyethyl)stannane?
dibutyl-chloro-(2-ethoxyethyl)stannane has a molecular weight of 341.51 g/mol, XLogP of 4.81, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-chloro-(2-ethoxyethyl)stannane is sourced from PubChem (CID 15106091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).