2-Bromopyridine
Properties
- Molecular formula
- C5H4BrN
- Molar mass
- 158.00 g/mol
- Exact mass
- 156.9527 Da
- Density
- 1.6337 g/mL (at 20 °C)
- Melting point
- below 25 °C
- Boiling point
- 194.8 °C
- logP
- 1.84Crippen estimate
- Polar surface area
- 12.9 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H226 Flammable liquid and vapor16.7% of notifiers
- H301 Toxic if swallowed100% of notifiers
- H310 Fatal in contact with skin91.7% of notifiers
- H315 Causes skin irritation98.3% of notifiers
- H319 Causes serious eye irritation98.3% of notifiers
- H335 May cause respiratory irritation95% of notifiers
Aggregated from 60 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
109-04-6SMILES
Brc1ccccn1InChIKey
IMRWILPUOVGIMU-UHFFFAOYSA-NInChI
InChI=1S/C5H4BrN/c6-5-3-1-2-4-7-5/h1-4HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
7 names
- Pyridine, 2-bromo-
- o-Bromopyridine
- β-Bromopyridine
- 2-Pyridyl bromide
- NSC 8031
- 2-Bromopyridin
- Pyridin-2-yl bromide
Reactions
Work with 2-Bromopyridine
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
6-Bromo-2,2'-bipyridine10495-73-558 % similar
2,2′-Bipyridine366-18-748 % similar
2,6-Dibromopyridine626-05-148 % similar
2-(2-Bromophenyl)pyridine109306-86-744 % similar
2-Methylpyridine109-06-842 % similar
2-Chloropyridine109-09-142 % similar
2,2'-Dipyridylamine1202-34-242 % similar
2-Methylpyridine1333-41-142 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds