chempirical

p-Phenylazobenzoic acid

C13H10N2O2CAS 1562-93-2226.24 g/mol

Open in Covalent MOL file
NNOOH
AzoCarboxylic acid

Properties

Molecular formula
C13H10N2O2
Molar mass
226.24 g/mol
Exact mass
226.0742 Da
logP
3.80Crippen estimate
Polar surface area
62.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
3

Identifiers

CAS number
1562-93-2
SMILES
C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)O
InChIKey
CSPTZWQFHBVOLO-UHFFFAOYSA-N
InChI
InChI=1S/C13H10N2O2/c16-13(17)10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h1-9H,(H,16,17)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

17 names · show all
  • 4-Phenyldiazenylbenzoic acid
  • 4-Phenylazobenzoic acid
  • 4-Carboxyazobenzene
  • Azobenzene-4-carboxylic acid
  • Benzoic acid, p-(phenylazo)-
  • Benzoic acid, 4-(2-phenyldiazenyl)-
  • 4-(2-Phenyldiazenyl)benzoic acid
  • 4Carboxyazobenzene
  • pPhenylazobenzoic acid
  • 4(Phenylazo)benzoic acid
  • Azobenzene4carboxylic acid
  • Benzoic acid, p(phenylazo)
  • Benzoic acid, 4(phenylazo)
  • Benzoic acid, 4(2phenyldiazenyl)
  • Benzoic acid, 4-(phenylazo)-
  • Azoic acid
  • 4-(Phenyldiazenyl)benzoic acid

Work with p-Phenylazobenzoic acid

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

4,4′-(1,2-Diazenediyl)bis[benzoic acid]586-91-484 % similar Benzoic acid65-85-065 % similar [1,1′-Biphenyl]-4-carboxylic acid92-92-262 % similar Terephthalic acid100-21-060 % similar 4-Benzoylbenzoic acid611-95-060 % similar 4-Phenoxybenzoic acid2215-77-258 % similar Acedoben556-08-155 % similar [1,1′-Biphenyl]-4,4′-dicarboxylic acid787-70-254 % similar

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

Same formula

1,3-Di(2-pyridyl)-1,3-propanedione10198-89-7

Elsewhere

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