1-Methyl 2-nitro-1,4-benzenedicarboxylate

CAS Registry Number®

35092-89-8

CAS Name

1-Methyl 2-nitro-1,4-benzenedicarboxylate

Molecular Formula

C9H7NO6

Molecular Mass

225.15

Cite this Page

1-Methyl 2-nitro-1,4-benzenedicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35092-89-8 (retrieved 2024-11-22) (CAS RN: 35092-89-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    177-179 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H7NO6/c1-16-9(13)6-3-2-5(8(11)12)4-7(6)10(14)15/h2-4H,1H3,(H,11,12)

InChIKey

InChIKey=MIIADZYPHVTLPR-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1,4-Benzenedicarboxylic acid, 2-nitro-, 1-methyl ester
  • 1-Methyl 2-nitro-1,4-benzenedicarboxylate
  • 4-Methoxycarbonyl-3-nitrobenzoic acid
  • NSC 151109
  • 2-Nitroterephthalic acid 1-methyl ester

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration