5-(4-Nitrophenyl)-3-isoxazolecarboxylic acid

CAS Registry Number®

33282-25-6
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CAS Name

5-(4-Nitrophenyl)-3-isoxazolecarboxylic acid

Molecular Formula

C10H6N2O5

Molecular Mass

234.16

Cite this Page

5-(4-Nitrophenyl)-3-isoxazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=33282-25-6 (retrieved 2024-06-26) (CAS RN: 33282-25-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    176-177 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H6N2O5/c13-10(14)8-5-9(17-11-8)6-1-3-7(4-2-6)12(15)16/h1-5H,(H,13,14)

InChIKey

InChIKey=GBRSPKXOFRTAHS-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C=C(ON1)C2=CC=C(N(=O)=O)C=C2

Canonical SMILES

O=C(O)C1=NOC(=C1)C=2C=CC(=CC2)N(=O)=O

Other Names for this Substance

  • 3-Isoxazolecarboxylic acid, 5-(4-nitrophenyl)-
  • 3-Isoxazolecarboxylic acid, 5-(p-nitrophenyl)-
  • 5-(4-Nitrophenyl)-3-isoxazolecarboxylic acid

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