2-Nitro-α-oxo-5-(phenylmethoxy)benzenepropanoic acid

CAS Registry Number®

22424-59-5

CAS Name

2-Nitro-α-oxo-5-(phenylmethoxy)benzenepropanoic acid

Molecular Formula

C16H13NO6

Molecular Mass

315.28

Cite this Page

2-Nitro-α-oxo-5-(phenylmethoxy)benzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22424-59-5 (retrieved 2024-11-24) (CAS RN: 22424-59-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    100-105 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H13NO6/c18-15(16(19)20)9-12-8-13(6-7-14(12)17(21)22)23-10-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,19,20)

InChIKey

InChIKey=SPYNICUJKSZDMS-UHFFFAOYSA-N

SMILES

C(C(C(O)=O)=O)C1=C(N(=O)=O)C=CC(OCC2=CC=CC=C2)=C1

Canonical SMILES

O=C(O)C(=O)CC1=CC(OCC=2C=CC=CC2)=CC=C1N(=O)=O

Other Names for this Substance

  • Benzenepropanoic acid, 2-nitro-α-oxo-5-(phenylmethoxy)-
  • Pyruvic acid, [5-(benzyloxy)-2-nitrophenyl]-
  • 2-Nitro-α-oxo-5-(phenylmethoxy)benzenepropanoic acid

Deleted or Replaced CAS Registry Numbers

182366-93-4

CAS INSIGHTSTM
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