2-(3-Bromophenyl)benzothiazole

Catalog Number

19654-14-9

CAS

19654-14-9

IUPAC Name

2-(3-bromophenyl)-1,3-benzothiazole

Synonyms

2-(3-bromophenyl)-1,3-benzothiazole; 2-(3-bromophenyl)-1,3-benzothiazole

Molecular Weight

290.18

Molecular Formula

C13H8BrNS

Purity

99 %

Appearance

White powder

Boiling Point

409.2 ± 47.0 ℃ (predicted)

Density

1.545 ± 0.06 g/mL (predicted)

Canonical SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C13H8BrNS/c14-10-5-3-4-9(8-10)13-15-11-6-1-2-7-12(11)16-13/h1-8H

InChI Key

XCMGDNMMLIJSQA-UHFFFAOYSA-N