2-[(2,4-Dinitrophenyl)thio]benzothiazole

CAS Registry Number®

4230-91-5

CAS Name

2-[(2,4-Dinitrophenyl)thio]benzothiazole

Molecular Formula

C13H7N3O4S2

Molecular Mass

333.34

Cite this Page

2-[(2,4-Dinitrophenyl)thio]benzothiazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4230-91-5 (retrieved 2024-11-28) (CAS RN: 4230-91-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    157-159 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H7N3O4S2/c17-15(18)8-5-6-12(10(7-8)16(19)20)22-13-14-9-3-1-2-4-11(9)21-13/h1-7H

InChIKey

InChIKey=RCPUUVXIUIWMEE-UHFFFAOYSA-N

SMILES

S(C1=C(N(=O)=O)C=C(N(=O)=O)C=C1)C2=NC=3C(S2)=CC=CC3

Canonical SMILES

O=N(=O)C1=CC=C(SC2=NC=3C=CC=CC3S2)C(=C1)N(=O)=O

Other Names for this Substance

  • Benzothiazole, 2-[(2,4-dinitrophenyl)thio]-
  • Benzothiazole, 2-(2,4-dinitrophenylmercapto)-
  • 2-[(2,4-Dinitrophenyl)thio]benzothiazole
  • 2,4-Dinitrophenyl 2-benzothiazolyl sulfide
  • 2-(2,4-Dinitrophenylthio)benzothiazole

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