2-(3-Nitrophenyl)benzothiazole

CAS Registry Number®

22868-33-3

CAS Name

2-(3-Nitrophenyl)benzothiazole

Molecular Formula

C13H8N2O2S

Molecular Mass

256.28

Cite this Page

2-(3-Nitrophenyl)benzothiazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22868-33-3 (retrieved 2024-11-23) (CAS RN: 22868-33-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    186.8-187.3 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H8N2O2S/c16-15(17)10-5-3-4-9(8-10)13-14-11-6-1-2-7-12(11)18-13/h1-8H

InChIKey

InChIKey=QNYLRZBOTOWMAE-UHFFFAOYSA-N

SMILES

N(=O)(=O)C=1C=C(C2=NC=3C(S2)=CC=CC3)C=CC1

Canonical SMILES

O=N(=O)C=1C=CC=C(C1)C2=NC=3C=CC=CC3S2

Other Names for this Substance

  • Benzothiazole, 2-(3-nitrophenyl)-
  • Benzothiazole, 2-(m-nitrophenyl)-
  • 2-(3-Nitrophenyl)benzothiazole
  • 2-(m-Nitrophenyl)benzothiazole
  • 2-(3-Nitrophenyl)-1,3-benzothiazole

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