[diacetyloxy(phenyl)plumbyl] acetate

C12H14O6Pb — CID 16683284

IUPAC[diacetyloxy(phenyl)plumbyl] acetate
SMILESCC(=O)O[Pb](OC(C)=O)(OC(C)=O)c1ccccc1
InChIInChI=1S/C6H5.3C2H4O2.Pb/c1-2-4-6-5-3-1;3*1-2(3)4;/h1-5H;3*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyLCMPHIATIKTQMI-UHFFFAOYSA-K
MW461.44 g/mol
LogP0.52
Rot. Bonds4

About [diacetyloxy(phenyl)plumbyl] acetate

[diacetyloxy(phenyl)plumbyl] acetate (PubChem CID 16683284) has the molecular formula C12H14O6Pb and a molecular weight of 461.44 g/mol. Its IUPAC name is [diacetyloxy(phenyl)plumbyl] acetate.

Molecular Properties

Compound Name[diacetyloxy(phenyl)plumbyl] acetate
PubChem CID16683284
Molecular FormulaC12H14O6Pb
Molecular Weight461.44 g/mol
Exact Mass462.06
IUPAC Name[diacetyloxy(phenyl)plumbyl] acetate
SMILESCC(=O)O[Pb](OC(C)=O)(OC(C)=O)c1ccccc1
InChIInChI=1S/C6H5.3C2H4O2.Pb/c1-2-4-6-5-3-1;3*1-2(3)4;/h1-5H;3*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyLCMPHIATIKTQMI-UHFFFAOYSA-K
XLogP0.52
TPSA78.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.44
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [diacetyloxy(phenyl)plumbyl] acetate?
The IUPAC name of [diacetyloxy(phenyl)plumbyl] acetate (CID 16683284) is [diacetyloxy(phenyl)plumbyl] acetate.
What is the SMILES notation for [diacetyloxy(phenyl)plumbyl] acetate?
The canonical SMILES for [diacetyloxy(phenyl)plumbyl] acetate is CC(=O)O[Pb](OC(C)=O)(OC(C)=O)c1ccccc1.
What is the InChIKey of [diacetyloxy(phenyl)plumbyl] acetate?
The InChIKey is LCMPHIATIKTQMI-UHFFFAOYSA-K. The full InChI is InChI=1S/C6H5.3C2H4O2.Pb/c1-2-4-6-5-3-1;3*1-2(3)4;/h1-5H;3*1H3,(H,3,4);/q;;;;+3/p-3.
What are the key properties of [diacetyloxy(phenyl)plumbyl] acetate?
[diacetyloxy(phenyl)plumbyl] acetate has a molecular weight of 461.44 g/mol, XLogP of 0.52, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(phenyl)plumbyl] acetate is sourced from PubChem (CID 16683284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).