6-Nitro-2-oxo-3(2H)-benzoxazoleacetic acid

CAS Registry Number®

19739-41-4

CAS Name

6-Nitro-2-oxo-3(2H)-benzoxazoleacetic acid

Molecular Formula

C9H6N2O6

Molecular Mass

238.15

Cite this Page

6-Nitro-2-oxo-3(2H)-benzoxazoleacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19739-41-4 (retrieved 2024-11-23) (CAS RN: 19739-41-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    261-263 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H6N2O6/c12-8(13)4-10-6-2-1-5(11(15)16)3-7(6)17-9(10)14/h1-3H,4H2,(H,12,13)

InChIKey

InChIKey=IAYXNJKBPWCTMZ-UHFFFAOYSA-N

SMILES

C(C(O)=O)N1C=2C(=CC(N(=O)=O)=CC2)OC1=O

Canonical SMILES

O=C(O)CN1C(=O)OC2=CC(=CC=C21)N(=O)=O

Other Names for this Substance

  • 3(2H)-Benzoxazoleacetic acid, 6-nitro-2-oxo-
  • 3-Benzoxazolineacetic acid, 6-nitro-2-oxo-
  • 6-Nitro-2-oxo-3(2H)-benzoxazoleacetic acid
  • (6-Nitro-2-oxo-1,3-benzoxazol-3(2H)-yl)acetic acid
  • 2-(6-Nitro-2-oxobenzo[d]oxazol-3(2H)-yl)acetic acid

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