2,4,3λ2-benzodioxaplumbepine-1,5-dione

C8H4O4Pb — CID 16693909

IUPAC2,4,3λ2-benzodioxaplumbepine-1,5-dione
SMILESO=C1O[Pb]OC(=O)c2ccccc21
InChIInChI=1S/C8H6O4.Pb/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+2/p-2
InChIKeyYJOMWQQKPKLUBO-UHFFFAOYSA-L
MW371.32 g/mol
LogP0.55
Rot. Bonds

About 2,4,3λ2-benzodioxaplumbepine-1,5-dione

2,4,3λ2-benzodioxaplumbepine-1,5-dione (PubChem CID 16693909) has the molecular formula C8H4O4Pb and a molecular weight of 371.32 g/mol. Its IUPAC name is 2,4,3λ2-benzodioxaplumbepine-1,5-dione.

Molecular Properties

Compound Name2,4,3λ2-benzodioxaplumbepine-1,5-dione
PubChem CID16693909
Molecular FormulaC8H4O4Pb
Molecular Weight371.32 g/mol
Exact Mass371.99
IUPAC Name2,4,3λ2-benzodioxaplumbepine-1,5-dione
SMILESO=C1O[Pb]OC(=O)c2ccccc21
InChIInChI=1S/C8H6O4.Pb/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+2/p-2
InChIKeyYJOMWQQKPKLUBO-UHFFFAOYSA-L
XLogP0.55
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.32
LogP ≤ 50.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4,3λ2-benzodioxaplumbepine-1,5-dione?
The IUPAC name of 2,4,3λ2-benzodioxaplumbepine-1,5-dione (CID 16693909) is 2,4,3λ2-benzodioxaplumbepine-1,5-dione.
What is the SMILES notation for 2,4,3λ2-benzodioxaplumbepine-1,5-dione?
The canonical SMILES for 2,4,3λ2-benzodioxaplumbepine-1,5-dione is O=C1O[Pb]OC(=O)c2ccccc21.
What is the InChIKey of 2,4,3λ2-benzodioxaplumbepine-1,5-dione?
The InChIKey is YJOMWQQKPKLUBO-UHFFFAOYSA-L. The full InChI is InChI=1S/C8H6O4.Pb/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+2/p-2.
What are the key properties of 2,4,3λ2-benzodioxaplumbepine-1,5-dione?
2,4,3λ2-benzodioxaplumbepine-1,5-dione has a molecular weight of 371.32 g/mol, XLogP of 0.55, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,3λ2-benzodioxaplumbepine-1,5-dione is sourced from PubChem (CID 16693909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).