triphenylplumbyl acetate

C20H18O2Pb — CID 16682953

IUPACtriphenylplumbyl acetate
SMILESCC(=O)O[Pb](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/3C6H5.C2H4O2.Pb/c3*1-2-4-6-5-3-1;1-2(3)4;/h3*1-5H;1H3,(H,3,4);/q;;;;+1/p-1
InChIKeyUXLLXTLQVAJJIB-UHFFFAOYSA-M
MW497.56 g/mol
LogP2.22
Rot. Bonds4

About triphenylplumbyl acetate

triphenylplumbyl acetate (PubChem CID 16682953) has the molecular formula C20H18O2Pb and a molecular weight of 497.56 g/mol. Its IUPAC name is triphenylplumbyl acetate.

Molecular Properties

Compound Nametriphenylplumbyl acetate
PubChem CID16682953
Molecular FormulaC20H18O2Pb
Molecular Weight497.56 g/mol
Exact Mass498.11
IUPAC Nametriphenylplumbyl acetate
SMILESCC(=O)O[Pb](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/3C6H5.C2H4O2.Pb/c3*1-2-4-6-5-3-1;1-2(3)4;/h3*1-5H;1H3,(H,3,4);/q;;;;+1/p-1
InChIKeyUXLLXTLQVAJJIB-UHFFFAOYSA-M
XLogP2.22
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500497.56
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of triphenylplumbyl acetate?
The IUPAC name of triphenylplumbyl acetate (CID 16682953) is triphenylplumbyl acetate.
What is the SMILES notation for triphenylplumbyl acetate?
The canonical SMILES for triphenylplumbyl acetate is CC(=O)O[Pb](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of triphenylplumbyl acetate?
The InChIKey is UXLLXTLQVAJJIB-UHFFFAOYSA-M. The full InChI is InChI=1S/3C6H5.C2H4O2.Pb/c3*1-2-4-6-5-3-1;1-2(3)4;/h3*1-5H;1H3,(H,3,4);/q;;;;+1/p-1.
What are the key properties of triphenylplumbyl acetate?
triphenylplumbyl acetate has a molecular weight of 497.56 g/mol, XLogP of 2.22, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triphenylplumbyl acetate is sourced from PubChem (CID 16682953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).