oxalate;tetraphenylstannane;tin(4+)

C28H20O8Sn2 — CID 161101615

IUPACoxalate;tetraphenylstannane;tin(4+)
SMILESO=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].[Sn+4].c1ccc([Sn](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/4C6H5.2C2H2O4.2Sn/c4*1-2-4-6-5-3-1;2*3-1(4)2(5)6;;/h4*1-5H;2*(H,3,4)(H,5,6);;/q;;;;;;;+4/p-4
InChIKeyUIMUHICLYPKGHW-UHFFFAOYSA-J
MW721.88 g/mol
LogP-4.34
Rot. Bonds4

About oxalate;tetraphenylstannane;tin(4+)

oxalate;tetraphenylstannane;tin(4+) (PubChem CID 161101615) has the molecular formula C28H20O8Sn2 and a molecular weight of 721.88 g/mol. Its IUPAC name is oxalate;tetraphenylstannane;tin(4+).

Molecular Properties

Compound Nameoxalate;tetraphenylstannane;tin(4+)
PubChem CID161101615
Molecular FormulaC28H20O8Sn2
Molecular Weight721.88 g/mol
Exact Mass723.92
IUPAC Nameoxalate;tetraphenylstannane;tin(4+)
SMILESO=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].[Sn+4].c1ccc([Sn](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/4C6H5.2C2H2O4.2Sn/c4*1-2-4-6-5-3-1;2*3-1(4)2(5)6;;/h4*1-5H;2*(H,3,4)(H,5,6);;/q;;;;;;;+4/p-4
InChIKeyUIMUHICLYPKGHW-UHFFFAOYSA-J
XLogP-4.34
TPSA160.52 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500721.88
LogP ≤ 5-4.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of oxalate;tetraphenylstannane;tin(4+)?
The IUPAC name of oxalate;tetraphenylstannane;tin(4+) (CID 161101615) is oxalate;tetraphenylstannane;tin(4+).
What is the SMILES notation for oxalate;tetraphenylstannane;tin(4+)?
The canonical SMILES for oxalate;tetraphenylstannane;tin(4+) is O=C([O-])C(=O)[O-].O=C([O-])C(=O)[O-].[Sn+4].c1ccc([Sn](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of oxalate;tetraphenylstannane;tin(4+)?
The InChIKey is UIMUHICLYPKGHW-UHFFFAOYSA-J. The full InChI is InChI=1S/4C6H5.2C2H2O4.2Sn/c4*1-2-4-6-5-3-1;2*3-1(4)2(5)6;;/h4*1-5H;2*(H,3,4)(H,5,6);;/q;;;;;;;+4/p-4.
What are the key properties of oxalate;tetraphenylstannane;tin(4+)?
oxalate;tetraphenylstannane;tin(4+) has a molecular weight of 721.88 g/mol, XLogP of -4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for oxalate;tetraphenylstannane;tin(4+) is sourced from PubChem (CID 161101615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).