chempirical

2-Pyridinecarboxylic acid, 5,6-dichloro-

C6H3Cl2NO2CAS 88912-24-7192.00 g/mol

Open in Covalent MOL file
NClClOOH
Aryl halideCarboxylic acid

Properties

Molecular formula
C6H3Cl2NO2
Molar mass
192.00 g/mol
Exact mass
190.9541 Da
logP
2.09Crippen estimate
Polar surface area
50.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

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

Identifiers

CAS number
88912-24-7
SMILES
C1=CC(=NC(=C1Cl)Cl)C(=O)O
InChIKey
QOJNAEPFSUYAFL-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(6(10)11)9-5(3)8/h1-2H,(H,10,11)

Weigh it out

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Work with 2-Pyridinecarboxylic acid, 5,6-dichloro-

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

6-Chloro-5-fluoro-pyridine-2-carboxylic acid860296-24-865 % similar Dipicolinic acid499-83-257 % similar 3,6-Pyridazinedicarboxylic acid57266-70-355 % similar 1,10-Phenanthroline-2,9-dicarboxylic acid57709-61-253 % similar 6-Chloropicolinic acid4684-94-053 % similar 6-Chloro-3-pyridazinecarboxylic acid5096-73-153 % similar 2,2'-Bipyridine-6,6'-dicarboxylic acid4479-74-752 % similar 2-Chloropyrimidine-4-carboxylic acid149849-92-351 % similar

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

Same formula

3,5-Dichloroisonicotinic acid13958-93-5 Clopyralid1702-17-6 2,3-Dichloropyridine-4-carboxylic acid184416-84-0 2,4-Dichloronicotinic acid262423-77-8 2,3-Dichloronitrobenzene3209-22-1 2,6-Dichloronicotinic acid38496-18-3 5,6-Dichloronicotinic acid41667-95-2 2,6-Dichloroisonicotinic acid5398-44-7

Elsewhere

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