benzene-1,3-dicarboxylate;lead(2+)

C8H4O4Pb — CID 56842371

IUPACbenzene-1,3-dicarboxylate;lead(2+)
SMILESO=C([O-])c1cccc(C(=O)[O-])c1.[Pb+2]
InChIInChI=1S/C8H6O4.Pb/c9-7(10)5-2-1-3-6(4-5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+2/p-2
InChIKeyBDPKMOYPOICDTD-UHFFFAOYSA-L
MW371.32 g/mol
LogP-1.97
Rot. Bonds2

About benzene-1,3-dicarboxylate;lead(2+)

benzene-1,3-dicarboxylate;lead(2+) (PubChem CID 56842371) has the molecular formula C8H4O4Pb and a molecular weight of 371.32 g/mol. Its IUPAC name is benzene-1,3-dicarboxylate;lead(2+).

Molecular Properties

Compound Namebenzene-1,3-dicarboxylate;lead(2+)
PubChem CID56842371
Molecular FormulaC8H4O4Pb
Molecular Weight371.32 g/mol
Exact Mass371.99
IUPAC Namebenzene-1,3-dicarboxylate;lead(2+)
SMILESO=C([O-])c1cccc(C(=O)[O-])c1.[Pb+2]
InChIInChI=1S/C8H6O4.Pb/c9-7(10)5-2-1-3-6(4-5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+2/p-2
InChIKeyBDPKMOYPOICDTD-UHFFFAOYSA-L
XLogP-1.97
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.32
LogP ≤ 5-1.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

bis(benzene-1,3-dicarboxylate);ruthenium(4+)
CID 88500443
sodium 3-carboxybenzoate
CID 23668865
dipotassium;3-sulfidocarbonylbenzoate
CID 141023598
calcium;3-carboxybenzoate;hydroxide
CID 140685957
benzene-1,3-dicarboxylate;bis(tetraphenylphosphanium)
CID 20544407
sodium 3-phosphanylbenzoate
CID 162334368
cesium 3-aminobenzoate
CID 134897140
gallium tris(3-methylbenzoate)
CID 22604030
bismuth tris(3-fluorobenzoate)
CID 132504465
CID 101297342
CID 101297342
disodium;3-[(3-carboxylatophenyl)diazenyl]benzoate
CID 101498255
diazanium;3-[3-(3-carboxylatobenzoyl)oxyphenoxy]carbonylbenzoate
CID 23310708

Frequently Asked Questions

What is the IUPAC name of benzene-1,3-dicarboxylate;lead(2+)?
The IUPAC name of benzene-1,3-dicarboxylate;lead(2+) (CID 56842371) is benzene-1,3-dicarboxylate;lead(2+).
What is the SMILES notation for benzene-1,3-dicarboxylate;lead(2+)?
The canonical SMILES for benzene-1,3-dicarboxylate;lead(2+) is O=C([O-])c1cccc(C(=O)[O-])c1.[Pb+2].
What is the InChIKey of benzene-1,3-dicarboxylate;lead(2+)?
The InChIKey is BDPKMOYPOICDTD-UHFFFAOYSA-L. The full InChI is InChI=1S/C8H6O4.Pb/c9-7(10)5-2-1-3-6(4-5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+2/p-2.
What are the key properties of benzene-1,3-dicarboxylate;lead(2+)?
benzene-1,3-dicarboxylate;lead(2+) has a molecular weight of 371.32 g/mol, XLogP of -1.97, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzene-1,3-dicarboxylate;lead(2+) is sourced from PubChem (CID 56842371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).