tribenzoyloxystannyl benzoate

C28H20O8Sn — CID 16693357

IUPACtribenzoyloxystannyl benzoate
SMILESO=C(O[Sn](OC(=O)c1ccccc1)(OC(=O)c1ccccc1)OC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/4C7H6O2.Sn/c4*8-7(9)6-4-2-1-3-5-6;/h4*1-5H,(H,8,9);/q;;;;+4/p-4
InChIKeyHXJNZPXGMGELDP-UHFFFAOYSA-J
MW603.17 g/mol
LogP4.85
Rot. Bonds8

About tribenzoyloxystannyl benzoate

tribenzoyloxystannyl benzoate (PubChem CID 16693357) has the molecular formula C28H20O8Sn and a molecular weight of 603.17 g/mol. Its IUPAC name is tribenzoyloxystannyl benzoate.

Molecular Properties

Compound Nametribenzoyloxystannyl benzoate
PubChem CID16693357
Molecular FormulaC28H20O8Sn
Molecular Weight603.17 g/mol
Exact Mass604.02
IUPAC Nametribenzoyloxystannyl benzoate
SMILESO=C(O[Sn](OC(=O)c1ccccc1)(OC(=O)c1ccccc1)OC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/4C7H6O2.Sn/c4*8-7(9)6-4-2-1-3-5-6;/h4*1-5H,(H,8,9);/q;;;;+4/p-4
InChIKeyHXJNZPXGMGELDP-UHFFFAOYSA-J
XLogP4.85
TPSA105.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500603.17
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of tribenzoyloxystannyl benzoate?
The IUPAC name of tribenzoyloxystannyl benzoate (CID 16693357) is tribenzoyloxystannyl benzoate.
What is the SMILES notation for tribenzoyloxystannyl benzoate?
The canonical SMILES for tribenzoyloxystannyl benzoate is O=C(O[Sn](OC(=O)c1ccccc1)(OC(=O)c1ccccc1)OC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of tribenzoyloxystannyl benzoate?
The InChIKey is HXJNZPXGMGELDP-UHFFFAOYSA-J. The full InChI is InChI=1S/4C7H6O2.Sn/c4*8-7(9)6-4-2-1-3-5-6;/h4*1-5H,(H,8,9);/q;;;;+4/p-4.
What are the key properties of tribenzoyloxystannyl benzoate?
tribenzoyloxystannyl benzoate has a molecular weight of 603.17 g/mol, XLogP of 4.85, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tribenzoyloxystannyl benzoate is sourced from PubChem (CID 16693357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).