Methyl 4-bromo-2,6-dinitrobenzoate

CAS Registry Number®

1272756-03-2
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CAS Name

Methyl 4-bromo-2,6-dinitrobenzoate

Molecular Formula

C8H5BrN2O6

Cite this Page

Methyl 4-bromo-2,6-dinitrobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1272756-03-2 (retrieved 2024-09-09) (CAS RN: 1272756-03-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H5BrN2O6/c1-17-8(12)7-5(10(13)14)2-4(9)3-6(7)11(15)16/h2-3H,1H3

InChIKey

InChIKey=XFHBMIBQDDEXIX-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=C(N(=O)=O)C=C(Br)C=C1N(=O)=O

Canonical SMILES

O=C(OC)C=1C(=CC(Br)=CC1N(=O)=O)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 4-bromo-2,6-dinitro-, methyl ester
  • Methyl 4-bromo-2,6-dinitrobenzoate