chempirical

Mercury benzoate

C7H5HgO2CAS 583-15-3321.71 g/mol

Open in Covalent MOL file
O−OHg+
Carboxylic acid

Properties

Molecular formula
C7H5HgO2
Molar mass
321.71 g/mol
Exact mass
322.9996 Da
Melting point
165 °C
logP
1.38Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
583-15-3
SMILES
[O-]C(=O)c1ccccc1.[Hg+]
InChIKey
AINRUFPWSLJTCA-UHFFFAOYSA-N
InChI
InChI=1S/C7H6O2.Hg/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);

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Names and synonyms

6 names
  • Benzoic acid, mercury(2+) salt (2:1)
  • Benzoic acid, mercury(2+) salt
  • Mercuric benzoate
  • β-Mercuribenzoate
  • Mercury(II) benzoate
  • Mercuribenzoate

Work with Mercury benzoate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ferric benzoate14534-87-375 % similar Calcium benzoate2090-05-375 % similar Silver benzoate532-31-075 % similar Sodium benzoate532-32-175 % similar Lithium benzoate553-54-875 % similar Zinc benzoate553-72-075 % similar Potassium benzoate582-25-275 % similar 1-Benzyl-3-carboxypyridinium hydroxide inner salt15990-43-947 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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