chempirical

Quinaldic acid

C10H7NO2CAS 93-10-7173.17 g/mol

Open in Covalent MOL file
OHON
Carboxylic acid

Properties

Molecular formula
C10H7NO2
Molar mass
173.17 g/mol
Exact mass
173.0477 Da
Melting point
156 °C
logP
1.93Crippen estimate
Polar surface area
50.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
93-10-7
SMILES
O=C(O)c1ccc2ccccc2n1
InChIKey
LOAUVZALPPNFOQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H7NO2/c12-10(13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H,12,13)

Weigh it out

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

Names and synonyms

7 names
  • 2-Quinolinecarboxylic acid
  • Quinaldinic acid
  • 2-Carboxyquinoline
  • 2-Quinolinylcarboxylic acid
  • NSC 4882
  • Quinolin-2-carboxylic acid
  • 2-Quinolinic acid

Work with Quinaldic 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

8-Hydroxyquinoline-2-carboxylic acid1571-30-858 % similar Dipicolinic acid499-83-257 % similar 2,3-Quinolinedicarboxylic acid643-38-954 % similar 1H-Pyrrolo[3,2-B]pyridine-5-carboxylic acid872355-64-151 % similar 2-Chloro-3-quinolinecarboxylic acid73776-25-751 % similar 4-Methoxy-2-quinolinecarboxylic acid15733-83-249 % similar 6-Hydroxypicolinic acid19621-92-249 % similar 6-Chloropicolinic acid4684-94-049 % similar

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

Same formula

α-Cyanocinnamic acid1011-92-3 6-Quinolinecarboxylic acid10349-57-2 6-Isoquinolinecarboxylic acid106778-43-2 1-Nitroso-2-naphthol131-91-9 2-Nitroso-1-naphthol132-53-6 8-Hydroxyquinoline-2-carboxaldehyde14510-06-6 3-(4-Cyanophenyl)-2-propenoic acid18664-39-6 Vinylphthalimide3485-84-5

Elsewhere

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