chempirical

2,6-Pyridinedicarbonyl dichloride

C7H3Cl2NO2CAS 3739-94-4204.01 g/mol

Open in Covalent MOL file
OClOClN
Acyl halide

Properties

Molecular formula
C7H3Cl2NO2
Molar mass
204.01 g/mol
Exact mass
202.9541 Da
Melting point
60–61.5 °C
Boiling point
163 °C (at 15 Torr)
logP
1.84Crippen estimate
Polar surface area
47.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Identifiers

CAS number
3739-94-4
SMILES
O=C(Cl)c1cccc(C(=O)Cl)n1
InChIKey
GWHOGODUVLQCEB-UHFFFAOYSA-N
InChI
InChI=1S/C7H3Cl2NO2/c8-6(11)4-2-1-3-5(10-4)7(9)12/h1-3H

Weigh it out

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Names and synonyms

8 names
  • 2,6-Pyridinedicarbonyl chloride
  • 2,6-Pyridinedicarboxylic acid dichloride
  • 2,6-Bis(chlorocarbonyl)pyridine
  • 2,6-Dicarbonylpyridine dichloride
  • (2,6-Chlorocarbonyl)pyridine
  • Pyridine-2,6-bis(carbonyl chloride)
  • 2,6-Pyridinedicarboxylic acid chloride
  • Pyridine-2,6-dicarboxylic chloride

Work with 2,6-Pyridinedicarbonyl dichloride

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

Isophthaloyl chloride99-63-850 % similar 2,6-Diacetylpyridine1129-30-248 % similar 2,6-Dichlorobenzoyl chloride4659-45-448 % similar Dipicolinic acid499-83-248 % similar Phthaloyl chloride88-95-948 % similar Benzoyl chloride98-88-446 % similar Terephthaloyl chloride100-20-946 % similar 2,6-Difluorobenzoyl chloride18063-02-045 % similar

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

Elsewhere

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