structure of 1H-Pyrrolo[2,3-B]pyridine, 6-bromo-1-(phenylsulfonyl)-

1H-Pyrrolo[2,3-B]pyridine, 6-bromo-1-(phenylsulfonyl)-

CAS No.: 1001070-23-0
M. Wt: 337.192
M. Fa: C13H9BrN2O2S
InChI Key: RCCRLERZFDSBII-UHFFFAOYSA-N

Names and Identifiers of 1001070-23-0

CAS Number

1001070-23-0

IUPAC Name

1-(benzenesulfonyl)-6-bromopyrrolo[2,3-b]pyridine

InChI

InChI=1S/C13H9BrN2O2S/c14-12-7-6-10-8-9-16(13(10)15-12)19(17,18)11-4-2-1-3-5-11/h1-9H

InChIKey

RCCRLERZFDSBII-UHFFFAOYSA-N

Canonical SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2N=C(C=C3)Br

Physical and chemical properties of 1001070-23-0

Boiling Point

508.5±53.0 °C at 760 mmHg

Density

1.6±0.1 g/cm3

Exact Mass

335.956818

Flash Point

261.3±30.9 °C

Index of Refraction

1.700

LogP

3.19

Molecular Formula

C13H9BrN2O2S

Molecular Weight

337.192

PSA

60.34000

Vapour Pressure

0.0±1.3 mmHg at 25°C

Safety Information of 1001070-23-0

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Retrosynthesis analysis of 1001070-23-0

  • Route#1

    Cas:143468-13-7
    Cas:98-09-9
    Cas:1001070-23-0