2-Chloro-5-iodo-3-pyridinecarbonitrile

C₆H₂ClIN₂CAS 766515-34-8264.45 g/mol

Open in Covalent MOL file

Aryl halide Nitrile

Properties

Molecular formula: C₆H₂ClIN₂
Molar mass: 264.45 g/mol
Exact mass: 263.8951 Da
logP: 2.21Crippen estimate
Polar surface area: 36.7 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

766515-34-8

SMILES

N#Cc1cc(I)cnc1Cl

InChIKey

FYHRQFFVACXNTB-UHFFFAOYSA-N

InChI

InChI=1S/C6H2ClIN2/c7-6-4(2-9)1-5(8)3-10-6/h1,3H

Weigh it out

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

Names and synonyms

3 names

3-Pyridinecarbonitrile, 2-chloro-5-iodo-
2-Chloro-5-iodonicotinonitrile
2-Chloro-5-iodopyridine-3-carbonitrile

Work with 2-Chloro-5-iodo-3-pyridinecarbonitrile

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

5-Bromo-2-chloro-3-pyridinecarbonitrile405224-23-959 % similar 2-Chloro-5-iodobenzonitrile289039-29-849 % similar 2-Chloro-5-iodo-3-nitropyridine426463-05-043 % similar 6-Chloro-4-methyl-3-pyridinecarbonitrile66909-35-142 % similar 2-Fluoro-5-iodobenzonitrile351003-36-641 % similar 3-Chloropyridazine-4-carbonitrile1445-56-338 % similar 2-Fluoro-4-iodobenzonitrile137553-42-537 % similar 3,5-Dichloro-2-pyrazinecarbonitrile313339-92-337 % similar

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

Same formula

2-Chloro-4-iodonicotinonitrile1171919-75-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook