diethyltin(2+) sulfite

C4H10O3SSn — CID 175907900

IUPACdiethyltin(2+) sulfite
SMILESCC[Sn+2]CC.O=S([O-])[O-]
InChIInChI=1S/2C2H5.H2O3S.Sn/c2*1-2;1-4(2)3;/h2*1H2,2H3;(H2,1,2,3);/q;;;+2/p-2
InChIKeyCJAVDJJQFOUFQJ-UHFFFAOYSA-L
MW256.90 g/mol
LogP0.56
Rot. Bonds2

About diethyltin(2+) sulfite

diethyltin(2+) sulfite (PubChem CID 175907900) has the molecular formula C4H10O3SSn and a molecular weight of 256.90 g/mol. Its IUPAC name is diethyltin(2+) sulfite.

Molecular Properties

Compound Namediethyltin(2+) sulfite
PubChem CID175907900
Molecular FormulaC4H10O3SSn
Molecular Weight256.90 g/mol
Exact Mass257.94
IUPAC Namediethyltin(2+) sulfite
SMILESCC[Sn+2]CC.O=S([O-])[O-]
InChIInChI=1S/2C2H5.H2O3S.Sn/c2*1-2;1-4(2)3;/h2*1H2,2H3;(H2,1,2,3);/q;;;+2/p-2
InChIKeyCJAVDJJQFOUFQJ-UHFFFAOYSA-L
XLogP0.56
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.90
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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disodium;sulfite
CID 516934
bis(lutetium(3+));trisulfite
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Frequently Asked Questions

What is the IUPAC name of diethyltin(2+) sulfite?
The IUPAC name of diethyltin(2+) sulfite (CID 175907900) is diethyltin(2+) sulfite.
What is the SMILES notation for diethyltin(2+) sulfite?
The canonical SMILES for diethyltin(2+) sulfite is CC[Sn+2]CC.O=S([O-])[O-].
What is the InChIKey of diethyltin(2+) sulfite?
The InChIKey is CJAVDJJQFOUFQJ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C2H5.H2O3S.Sn/c2*1-2;1-4(2)3;/h2*1H2,2H3;(H2,1,2,3);/q;;;+2/p-2.
What are the key properties of diethyltin(2+) sulfite?
diethyltin(2+) sulfite has a molecular weight of 256.90 g/mol, XLogP of 0.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethyltin(2+) sulfite is sourced from PubChem (CID 175907900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).