5-Chloro-7-nitro-1H-benzotriazole

CAS Registry Number®

13091-80-0
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CAS Name

5-Chloro-7-nitro-1H-benzotriazole

Molecular Formula

C6H3ClN4O2

Molecular Mass

198.57

Cite this Page

5-Chloro-7-nitro-1H-benzotriazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13091-80-0 (retrieved 2024-05-17) (CAS RN: 13091-80-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    238-239 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H3ClN4O2/c7-3-1-4-6(9-10-8-4)5(2-3)11(12)13/h1-2H,(H,8,9,10)

InChIKey

InChIKey=HRBBUEDJKCLTQE-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C2C(=CC(Cl)=C1)N=NN2

Canonical SMILES

O=N(=O)C1=CC(Cl)=CC=2N=NNC21

Other Names for this Substance

  • 1H-Benzotriazole, 5-chloro-7-nitro-
  • 1H-Benzotriazole, 6-chloro-4-nitro-
  • Benzotriazole, 6-chloro-4-nitro-
  • 5-Chloro-7-nitro-1H-benzotriazole
  • 4-Nitro-6-chlorobenzotriazole

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Deleted or Replaced CAS Registry Numbers

30773-59-2

CAS INSIGHTSTM
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