[diacetyloxy(naphthalen-1-yl)plumbyl] acetate

C16H16O6Pb — CID 16705173

IUPAC[diacetyloxy(naphthalen-1-yl)plumbyl] acetate
SMILESCC(=O)O[Pb](OC(C)=O)(OC(C)=O)c1cccc2ccccc12
InChIInChI=1S/C10H7.3C2H4O2.Pb/c1-2-6-10-8-4-3-7-9(10)5-1;3*1-2(3)4;/h1-7H;3*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyGWIVISGZMFJYAG-UHFFFAOYSA-K
MW511.50 g/mol
LogP1.67
Rot. Bonds4

About [diacetyloxy(naphthalen-1-yl)plumbyl] acetate

[diacetyloxy(naphthalen-1-yl)plumbyl] acetate (PubChem CID 16705173) has the molecular formula C16H16O6Pb and a molecular weight of 511.50 g/mol. Its IUPAC name is [diacetyloxy(naphthalen-1-yl)plumbyl] acetate.

Molecular Properties

Compound Name[diacetyloxy(naphthalen-1-yl)plumbyl] acetate
PubChem CID16705173
Molecular FormulaC16H16O6Pb
Molecular Weight511.50 g/mol
Exact Mass512.07
IUPAC Name[diacetyloxy(naphthalen-1-yl)plumbyl] acetate
SMILESCC(=O)O[Pb](OC(C)=O)(OC(C)=O)c1cccc2ccccc12
InChIInChI=1S/C10H7.3C2H4O2.Pb/c1-2-6-10-8-4-3-7-9(10)5-1;3*1-2(3)4;/h1-7H;3*1H3,(H,3,4);/q;;;;+3/p-3
InChIKeyGWIVISGZMFJYAG-UHFFFAOYSA-K
XLogP1.67
TPSA78.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500511.50
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [diacetyloxy(naphthalen-1-yl)plumbyl] acetate?
The IUPAC name of [diacetyloxy(naphthalen-1-yl)plumbyl] acetate (CID 16705173) is [diacetyloxy(naphthalen-1-yl)plumbyl] acetate.
What is the SMILES notation for [diacetyloxy(naphthalen-1-yl)plumbyl] acetate?
The canonical SMILES for [diacetyloxy(naphthalen-1-yl)plumbyl] acetate is CC(=O)O[Pb](OC(C)=O)(OC(C)=O)c1cccc2ccccc12.
What is the InChIKey of [diacetyloxy(naphthalen-1-yl)plumbyl] acetate?
The InChIKey is GWIVISGZMFJYAG-UHFFFAOYSA-K. The full InChI is InChI=1S/C10H7.3C2H4O2.Pb/c1-2-6-10-8-4-3-7-9(10)5-1;3*1-2(3)4;/h1-7H;3*1H3,(H,3,4);/q;;;;+3/p-3.
What are the key properties of [diacetyloxy(naphthalen-1-yl)plumbyl] acetate?
[diacetyloxy(naphthalen-1-yl)plumbyl] acetate has a molecular weight of 511.50 g/mol, XLogP of 1.67, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(naphthalen-1-yl)plumbyl] acetate is sourced from PubChem (CID 16705173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).