2,5-Dimethoxy-3-nitrobenzoic acid

CAS Registry Number®

17894-26-7
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CAS Name

2,5-Dimethoxy-3-nitrobenzoic acid

Molecular Formula

C9H9NO6

Molecular Mass

227.17

Cite this Page

2,5-Dimethoxy-3-nitrobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17894-26-7 (retrieved 2024-08-01) (CAS RN: 17894-26-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    181-183 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9NO6/c1-15-5-3-6(9(11)12)8(16-2)7(4-5)10(13)14/h3-4H,1-2H3,(H,11,12)

InChIKey

InChIKey=QCJROOYLFVYZEP-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C1=CC(OC)=CC(=C1OC)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 2,5-dimethoxy-3-nitro-
  • 2,5-Dimethoxy-3-nitrobenzoic acid