Sodium benzoate

C7H5NaO2CAS 532-32-1144.10 g/mol

Open in Covalent MOL file
O−ONa+
Carboxylic acid

Properties

Molecular formula
C7H5NaO2
Molar mass
144.10 g/mol
Exact mass
144.0187 Da
Melting point
above 300 °C
logP
1.00Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
532-32-1
SMILES
[O-]C(=O)c1ccccc1.[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

Weigh it out

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Names and synonyms

14 names · show all
  • Benzoic acid, sodium salt (1:1)
  • Benzoic acid, sodium salt
  • Antimol
  • Benzoate of soda
  • Sobenate
  • E 211
  • Fuminaru
  • Purox S
  • E 221
  • E 221 (Nucleating agent)
  • Microcare SB
  • Probenz
  • FZ 001
  • NB 3010C

Work with Sodium 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Benzoic acid65-85-0Free acid Denatonium3734-33-6Salt Ammonium benzoate1863-63-4Salt Calcium benzoate2090-05-3Salt Potassium benzoate582-25-2Salt Emamectin benzoate137512-74-4Salt Emamectin benzoate155569-91-8Salt Rizatriptan benzoate145202-66-0Salt Mercury benzoate583-15-3Salt Silver benzoate532-31-0Salt Ferric benzoate14534-87-3Salt Zinc benzoate553-72-0Salt

Similar compounds

Sodium p-hydroxybenzoate114-63-661 % similar Sodium p-fluorobenzoate499-90-161 % similar Sodium p-aminobenzoate555-06-661 % similar Sodium m-fluorobenzoate499-57-060 % similar Sodium nicotinate54-86-460 % similar 4-Trifluoromethylbenzoic acid sodium salt25832-58-055 % similar Sodium 3-trifluoromethylbenzoate69226-41-153 % similar Sodium o-fluorobenzoate490-97-152 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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