3-Methoxy-4-nitro-5-isoxazolepropanoic acid

CAS Registry Number®

861591-89-1
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CAS Name

3-Methoxy-4-nitro-5-isoxazolepropanoic acid

Molecular Formula

C7H8N2O6

Molecular Mass

216.15

Cite this Page

3-Methoxy-4-nitro-5-isoxazolepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=861591-89-1 (retrieved 2024-09-19) (CAS RN: 861591-89-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H8N2O6/c1-14-7-6(9(12)13)4(15-8-7)2-3-5(10)11/h2-3H2,1H3,(H,10,11)

InChIKey

InChIKey=SIUVETIISOKNQL-UHFFFAOYSA-N

SMILES

C(CC(O)=O)C1=C(N(=O)=O)C(OC)=NO1

Canonical SMILES

O=C(O)CCC=1ON=C(OC)C1N(=O)=O

Other Names for this Substance

  • 5-Isoxazolepropanoic acid, 3-methoxy-4-nitro-
  • 5-Isoxazolepropionic acid, 3-methoxy-4-nitro-
  • 3-Methoxy-4-nitro-5-isoxazolepropanoic acid