chempirical

4-Chloropicolinaldehyde

C6H4ClNOCAS 63071-13-6141.55 g/mol

Open in Covalent MOL file
NClO
AldehydeAryl halide

Properties

Molecular formula
C6H4ClNO
Molar mass
141.55 g/mol
Exact mass
140.9981 Da
logP
1.55Crippen estimate
Polar surface area
30.0 Ų
H-bond donors / acceptors
0 / 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
63071-13-6
SMILES
C1=CN=C(C=C1Cl)C=O
InChIKey
NZLNQSUMFSPISS-UHFFFAOYSA-N
InChI
InChI=1S/C6H4ClNO/c7-5-1-2-8-6(3-5)4-9/h1-4H

Weigh it out

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

Names and synonyms

1 names
  • 4-Chloropyridine-2-carbaldehyde

Work with 4-Chloropicolinaldehyde

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-Bromopyridine-2-carbaldehyde131747-63-255 % similar 4-Methylpyridine-2-carbaldehyde53547-60-755 % similar 4,4'-Dichloro-2,2'-bipyridine1762-41-052 % similar 2,4-Dichloropyridine26452-80-248 % similar Pyridine-2-carbaldehyde1121-60-447 % similar 4-Chloro-2-methoxypyridine72141-44-745 % similar 2-Bromo-4-chloropyridine22918-01-045 % similar 4-Chloro-2-fluoropyridine34941-92-945 % similar

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

Same formula

2-Chloro-4-pyridinecarboxaldehyde101066-61-9 4-Chloropyridine-3-carboxaldehyde114077-82-6 2-Chloropyridine-5-carbaldehyde23100-12-1 5-Chloropyridine-2-carboxaldehyde31181-89-2 2-Chloro-3-pyridinecarboxaldehyde36404-88-3 6-Chloropyridine-2-carbaldehyde54087-03-5 3-Chloro-4-pyridinecarboxaldehyde72990-37-5

Elsewhere

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