Benzoic acid, 4-amino-3-bromo-5-nitro-, ethyl ester

CAS Registry Number®

82760-42-7

CAS Name

Benzoic acid, 4-amino-3-bromo-5-nitro-, ethyl ester

Molecular Formula

C9H9BrN2O4

Molecular Mass

289.08

Cite this Page

Benzoic acid, 4-amino-3-bromo-5-nitro-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=82760-42-7 (retrieved 2024-11-24) (CAS RN: 82760-42-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H9BrN2O4/c1-2-16-9(13)5-3-6(10)8(11)7(4-5)12(14)15/h3-4H,2,11H2,1H3

InChIKey

InChIKey=QANVLXVFIRTXFG-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1=CC(N(=O)=O)=C(N)C(Br)=C1

Canonical SMILES

O=C(OCC)C1=CC(Br)=C(N)C(=C1)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 4-amino-3-bromo-5-nitro-, ethyl ester
  • Ethyl 4-amino-3-bromo-5-nitrobenzoate

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