7-Bromo-2,1,3-benzothiadiazole-4-carboxylic acid

CAS Registry Number®

3529-60-0
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CAS Name

7-Bromo-2,1,3-benzothiadiazole-4-carboxylic acid

Molecular Formula

C7H3BrN2O2S

Molecular Mass

259.08

Cite this Page

7-Bromo-2,1,3-benzothiadiazole-4-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3529-60-0 (retrieved 2024-09-09) (CAS RN: 3529-60-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    216-217 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H3BrN2O2S/c8-4-2-1-3(7(11)12)5-6(4)10-13-9-5/h1-2H,(H,11,12)

InChIKey

InChIKey=RCMREEKAOGZCFD-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C=2C(C(Br)=CC1)=NSN2

Canonical SMILES

O=C(O)C1=CC=C(Br)C2=NSN=C21

Other Names for this Substance

  • 2,1,3-Benzothiadiazole-4-carboxylic acid, 7-bromo-
  • 7-Bromo-2,1,3-benzothiadiazole-4-carboxylic acid