2,2-Dihydroxy-1-(4-nitrophenyl)ethanone

CAS Registry Number®

4996-22-9

CAS Name

2,2-Dihydroxy-1-(4-nitrophenyl)ethanone

Molecular Formula

C8H7NO5

Molecular Mass

197.14

Cite this Page

2,2-Dihydroxy-1-(4-nitrophenyl)ethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4996-22-9 (retrieved 2024-11-28) (CAS RN: 4996-22-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    90-91 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H7NO5/c10-7(8(11)12)5-1-3-6(4-2-5)9(13)14/h1-4,8,11-12H

InChIKey

InChIKey=DUGSDYIJZMWGNA-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Ethanone, 2,2-dihydroxy-1-(4-nitrophenyl)-
  • Acetophenone, 2,2-dihydroxy-4′-nitro-
  • 2,2-Dihydroxy-1-(4-nitrophenyl)ethanone
  • NSC 131639
  • (4-Nitrophenyl)glyoxal monohydrate

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