chempirical

Picolinic acid hydrochloride

C6H6ClNO2CAS 636-80-6159.57 g/mol

Open in Covalent MOL file
NOOHHCl
Carboxylic acid

Properties

Molecular formula
C6H6ClNO2
Molar mass
159.57 g/mol
Exact mass
159.0087 Da
logP
1.20Crippen estimate
Polar surface area
50.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
636-80-6
SMILES
C1=CC=NC(=C1)C(=O)O.Cl
InChIKey
HFAFXVOPGDBAOK-UHFFFAOYSA-N
InChI
InChI=1S/C6H5NO2.ClH/c8-6(9)5-3-1-2-4-7-5;/h1-4H,(H,8,9);1H

Weigh it out

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

Names and synonyms

6 names
  • Pyridine-2-carboxylic acid;hydrochloride
  • 2-Pyridinecarboxylic acid, hydrochloride
  • Alpha-Picolinic acid hydrochloride
  • Pyridine-2-carboxylic Acid Hydrochloride
  • Picolinic acid HCl
  • 2-Picolinic acid hydrochloride

Reactions

Work with Picolinic acid hydrochloride

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.

Picolinic acid98-98-6Free base Chromium(III) picolinate14639-25-9Salt Zinc picolinate17949-65-4Salt Oxobis(picolinato)vanadium14049-90-2Salt

Similar compounds

Picolinoyl chloride hydrochloride39901-94-558 % similar 4-Aminopyridine-2-carboxylic acid hydrochloride1291487-29-056 % similar 2-Pyridyl ketone19437-26-453 % similar 2,2′-Pyridil492-73-953 % similar Dipicolinic acid499-83-253 % similar Pyridazine-3-carboxylic acid2164-61-652 % similar 4-Pyrimidinecarboxylic acid31462-59-652 % similar 4-Fluoro-2-pyridinecarboxylic acid886371-78-451 % similar

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

Same formula

Methyl 3-chloro-1H-pyrrole-2-carboxylate226410-00-0 3,5-Dimethylisoxazole-4-carbonyl chloride31301-45-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook