2-(4-Bromophenyl)pyriding

C11H8BrNCAS 63996-36-1234.10 g/mol

Open in Covalent MOL file
NBr
Aryl halide

Properties

Molecular formula
C11H8BrN
Molar mass
234.10 g/mol
Exact mass
232.9840 Da
logP
3.51Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
63996-36-1
SMILES
C1=CC=NC(=C1)C2=CC=C(C=C2)Br
InChIKey
FBQFCXDBCPREBP-UHFFFAOYSA-N
InChI
InChI=1S/C11H8BrN/c12-10-6-4-9(5-7-10)11-3-1-2-8-13-11/h1-8H

Weigh it out

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Names and synonyms

1 names
  • 2-(4-Bromophenyl)pyridine

Work with 2-(4-Bromophenyl)pyriding

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′-(4-Bromophenyl)-2,2′:6′,2′′-terpyridine89972-76-968 % similar 2-(4-Hydroxypenyl)pyridine51035-40-664 % similar 2-Phenylpyridine1008-89-564 % similar 2,4'-Bipyridine581-47-559 % similar 2-(4-Methylphenyl)pyridine4467-06-559 % similar 2-(4-Fluorophenyl)pyridine58861-53-359 % similar 2-(4-Chlorophenyl)pyridine5969-83-559 % similar 4-Bromo-2,2'-bipyridyl14162-95-957 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(2-Bromophenyl)pyridine109306-86-7 3-(4-Bromophenyl)pyridine129013-83-8 3-Bromo-5-phenylpyridine142137-17-5 5-Bromo-2-phenylpyridine27012-25-5 2-Bromo-6-phenylpyridine39774-26-0 4-(4-Bromophenyl)pyridine39795-60-3 2-(3-Bromophenyl)pyridine4373-60-8 3-Bromo-2-phenylpyridine91182-50-2

Elsewhere

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