butyl(2,2-dimethoxyethyl)tin

C8H18O2Sn — CID 87372194

IUPACbutyl(2,2-dimethoxyethyl)tin
SMILESCCCC[Sn]CC(OC)OC
InChIInChI=1S/C4H9O2.C4H9.Sn/c1-4(5-2)6-3;1-3-4-2;/h4H,1H2,2-3H3;1,3-4H2,2H3;
InChIKeyPTMHRBJNYMMDLW-UHFFFAOYSA-N
MW264.94 g/mol
LogP1.95
Rot. Bonds7

About butyl(2,2-dimethoxyethyl)tin

butyl(2,2-dimethoxyethyl)tin (PubChem CID 87372194) has the molecular formula C8H18O2Sn and a molecular weight of 264.94 g/mol. Its IUPAC name is butyl(2,2-dimethoxyethyl)tin.

Molecular Properties

Compound Namebutyl(2,2-dimethoxyethyl)tin
PubChem CID87372194
Molecular FormulaC8H18O2Sn
Molecular Weight264.94 g/mol
Exact Mass266.03
IUPAC Namebutyl(2,2-dimethoxyethyl)tin
SMILESCCCC[Sn]CC(OC)OC
InChIInChI=1S/C4H9O2.C4H9.Sn/c1-4(5-2)6-3;1-3-4-2;/h4H,1H2,2-3H3;1,3-4H2,2H3;
InChIKeyPTMHRBJNYMMDLW-UHFFFAOYSA-N
XLogP1.95
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.94
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze butyl(2,2-dimethoxyethyl)tin with MolForge

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

Launch Full Analysis

Related Compounds

butyl(3,3-dimethoxypropyl)tin
CID 87371389
dibutyltin
CID 6484
dibutyltin;methane
CID 158142869
dibutyltin;λ2-stannane
CID 174939385
dibutyltin;silane
CID 163880557
chloro hypochlorite;dibutyltin
CID 87460481
dibutyltin;dimethoxysilane
CID 157060986
1,1-dimethoxytetradecane
CID 13265409
1-butoxybutane;dibutyltin
CID 87184018
N-(2,2-dimethoxyethyl)dodecan-1-amine
CID 10308222
dibutyltin;1-heptoxyheptane
CID 87183821
dibutyltin;tris(ethane-1,1,1,2,2,2-hexol)
CID 173133836

Frequently Asked Questions

What is the IUPAC name of butyl(2,2-dimethoxyethyl)tin?
The IUPAC name of butyl(2,2-dimethoxyethyl)tin (CID 87372194) is butyl(2,2-dimethoxyethyl)tin.
What is the SMILES notation for butyl(2,2-dimethoxyethyl)tin?
The canonical SMILES for butyl(2,2-dimethoxyethyl)tin is CCCC[Sn]CC(OC)OC.
What is the InChIKey of butyl(2,2-dimethoxyethyl)tin?
The InChIKey is PTMHRBJNYMMDLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9O2.C4H9.Sn/c1-4(5-2)6-3;1-3-4-2;/h4H,1H2,2-3H3;1,3-4H2,2H3;.
What are the key properties of butyl(2,2-dimethoxyethyl)tin?
butyl(2,2-dimethoxyethyl)tin has a molecular weight of 264.94 g/mol, XLogP of 1.95, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl(2,2-dimethoxyethyl)tin is sourced from PubChem (CID 87372194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).