Sodium methylparaben

C8H7NaO3CAS 5026-62-0174.13 g/mol

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OOO−Na+
EsterPhenol

Properties

Molecular formula
C8H7NaO3
Molar mass
174.13 g/mol
Exact mass
174.0293 Da
logP
0.80Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
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
5026-62-0
SMILES
COC(=O)c1ccc([O-])cc1.[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.

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Names and synonyms

20 names · show all
  • Benzoic acid, 4-hydroxy-, methyl ester, sodium salt (1:1)
  • Benzoic acid, p-hydroxy-, methyl ester, sodium salt
  • Benzoic acid, 4-hydroxy-, methyl ester, sodium salt
  • Sodium, (p-carboxyphenoxy)-, methyl ester
  • Bonomold OMNa
  • Preserval MS
  • Solparol
  • Sodium methyl p-hydroxybenzoate
  • Methyl p-hydroxybenzoate sodium salt
  • Methyl 4-hydroxybenzoate sodium salt
  • p-Hydroxybenzoic acid methyl ester sodium salt
  • Sodium 4-carbomethoxyphenolate
  • 4-Hydroxybenzoic acid methyl ester sodium salt
  • Sodium p-methoxycarbonylphenoxide
  • Methylparaben sodium
  • Sodium 4-(methoxycarbonyl)phenoxide
  • Sodium methyl 4-hydroxybenzoate
  • Sodium p-methoxycarbonylphenolate
  • Sodium methyl para-hydroxybenzoate
  • Sodium nipagin

Work with Sodium methylparaben

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.

Methylparaben99-76-3Free acid

Similar compounds

Dimethyl terephthalate120-61-667 % similar Sodium ethyl p-hydroxybenzoate35285-68-863 % similar 4,4′-Dimethyl [1,1′-biphenyl]-4,4′-dicarboxylate792-74-560 % similar Propylparaben sodium35285-69-959 % similar Sodium butylparaben36457-20-256 % similar Methyl p-toluate99-75-256 % similar Methyl benzoate93-58-355 % similar Methyl 4-chlorobenzoate1126-46-155 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Sodium phenoxyacetate3598-16-1

Elsewhere

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