chempirical

Potassium benzoate

C7H5KO2CAS 582-25-2160.21 g/mol

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Carboxylic acid

Properties

Molecular formula
C7H5KO2
Molar mass
160.21 g/mol
Exact mass
159.9927 Da
Density
1.558 g/mL (at 20 °C)
logP
1.00Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
582-25-2
SMILES
[O-]C(=O)c1ccccc1.[K+]
InChIKey
MVHKJLPAUPVQIR-UHFFFAOYSA-N
InChI
InChI=1S/C7H6O2.K/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);

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Names and synonyms

3 names
  • Benzoic acid, potassium salt (1:1)
  • Benzoic acid, potassium salt
  • E 212

Work with Potassium 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 Mercury benzoate583-15-375 % similar Potassium P-aminobenzoate138-84-161 % similar

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

Elsewhere

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