chempirical

6-Bromopyridine-2-carbaldehyde

C6H4BrNOCAS 34160-40-2186.01 g/mol

Open in Covalent MOL file
OBrN
AldehydeAryl halide

Properties

Molecular formula
C6H4BrNO
Molar mass
186.01 g/mol
Exact mass
184.9476 Da
Melting point
80–81.5 °C
logP
1.66Crippen estimate
Polar surface area
30.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 51 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
34160-40-2
SMILES
O=Cc1cccc(Br)n1
InChIKey
QWFHFNGMCPMOCD-UHFFFAOYSA-N
InChI
InChI=1S/C6H4BrNO/c7-6-3-1-2-5(4-9)8-6/h1-4H

Weigh it out

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

Names and synonyms

12 names
  • 6-Bromo-2-pyridinecarboxaldehyde
  • 2-Pyridinecarboxaldehyde, 6-bromo-
  • Picolinaldehyde, 6-bromo-
  • 6-Bromo-2-formylpyridine
  • 2-Bromopyridine-6-carboxaldehyde
  • 6-Bromopicolylaldehyde
  • 2-Bromo-6-formylpyridine
  • 6-Bromopyridine-2-aldehyde
  • 2-Bromopyridyl-6-carboxaldehyde
  • 2-Formyl-6-bromopyridine
  • 6-Bromo-2-pyridinecarbaldehyde
  • 6-Bromopicolinaldehyde

Work with 6-Bromopyridine-2-carbaldehyde

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

2,6-Diformylpyridine5431-44-767 % similar 2,2'-Bipyridine-6,6'-dicarbaldehyde49669-26-359 % similar 6-Chloropyridine-2-carbaldehyde54087-03-555 % similar 2,6-Dibromopyridine626-05-154 % similar 6-Methyl-2-pyridinecarboxaldehyde1122-72-153 % similar 6-Fluoropyridine-2-carboxaldehyde208110-81-053 % similar 6-Methoxy-2-pyridinecarboxaldehyde54221-96-448 % similar 6,6'-Dibromo-2,2'-dipyridyl49669-22-948 % similar

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

Same formula

5-Bromo-3-pyridinecarboxaldehyde113118-81-3 2-Bromo-4-pyridinecarboxaldehyde118289-17-1 2-Bromonicotinaldehyde128071-75-0 4-Bromopyridine-2-carbaldehyde131747-63-2 6-Bromo-3-pyridinecarboxaldehyde149806-06-4 4-Bromopyridine-3-carbaldehyde154105-64-3 5-Bromopyridine-2-carbaldehyde31181-90-5 3-Bromo-2-pyridinecarboxaldehyde405174-97-2

Elsewhere

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