chempirical

2-(Tribromomethyl)quinoline

C10H6Br3NCAS 613-53-6379.88 g/mol

Open in Covalent MOL file
BrBrBrN
Alkyl halide

Properties

Molecular formula
C10H6Br3N
Molar mass
379.88 g/mol
Exact mass
376.8050 Da
Melting point
128 °C
logP
4.53Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
613-53-6
SMILES
BrC(Br)(Br)c1ccc2ccccc2n1
InChIKey
UDYYQHILRSDDMP-UHFFFAOYSA-N
InChI
InChI=1S/C10H6Br3N/c11-10(12,13)9-6-5-7-3-1-2-4-8(7)14-9/h1-6H

Weigh it out

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

Names and synonyms

5 names
  • Quinoline, 2-(tribromomethyl)-
  • Tribromoquinaldine
  • 2-Tribromomethylquinoline
  • α,α,α-Tribromoquinaldine
  • NSC 610

Work with 2-(Tribromomethyl)quinoline

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

2,2'-Biquinoline119-91-550 % similar 2-Hydrazinoquinoline15793-77-848 % similar 2-Quinolone59-31-445 % similar 2-Chloroquinoline612-62-445 % similar Quinaldine91-63-445 % similar 2-Phenylquinoline612-96-444 % similar Acridine260-94-643 % similar 2-Quinolinecarbonitrile1436-43-742 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook