Methyl 2-bromo-4-nitrobenzoate

CAS Registry Number®

100959-22-6

CAS Name

Methyl 2-bromo-4-nitrobenzoate

Molecular Formula

C8H6BrNO4

Molecular Mass

260.04

Cite this Page

Methyl 2-bromo-4-nitrobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=100959-22-6 (retrieved 2024-11-29) (CAS RN: 100959-22-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    82-85 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6BrNO4/c1-14-8(11)6-3-2-5(10(12)13)4-7(6)9/h2-4H,1H3

InChIKey

InChIKey=XYMZAFDNPJLOTP-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=C(Br)C=C(N(=O)=O)C=C1

Canonical SMILES

O=C(OC)C1=CC=C(C=C1Br)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 2-bromo-4-nitro-, methyl ester
  • Methyl 2-bromo-4-nitrobenzoate
  • 2-Bromo-4-nitro-benzoic acid methyl ester

CAS INSIGHTSTM
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