5-Chloro-2-fluoro-4-iodopyridine

C5H2ClFINCAS 659731-48-3257.43 g/mol

Open in Covalent MOL file
NFClI
Aryl halide

Properties

Molecular formula
C5H2ClFIN
Molar mass
257.43 g/mol
Exact mass
256.8905 Da
logP
2.48Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
659731-48-3
SMILES
C1=C(C(=CN=C1F)Cl)I
InChIKey
MAQBAWYSDZIKIC-UHFFFAOYSA-N
InChI
InChI=1S/C5H2ClFIN/c6-3-2-9-5(7)1-4(3)8/h1-2H

Weigh it out

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

Work with 5-Chloro-2-fluoro-4-iodopyridine

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

2,5-Difluoro-4-iodopyridine1017793-20-259 % similar 2-Fluoro-4-iodo-5-methylpyridine153034-94-757 % similar (5-Chloro-2-fluoropyridin-4-yl)boronic acid1034659-38-552 % similar 1-Chloro-4-fluoro-2-iodobenzene202982-68-144 % similar 1-Chloro-2-fluoro-3-iodobenzene72373-82-141 % similar 3-Chloro-4-iodopyridine77332-79-741 % similar 2-Chloro-4-fluoro-1-iodobenzene101335-11-939 % similar 2,3-Dichloro-5-fluoropyridine185985-40-439 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Chloro-3-fluoro-4-iodopyridine148639-07-0 2-Chloro-5-fluoro-4-iodopyridine884494-49-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook