Benzoic acid, 3-hydroxy-4-nitro-, ethyl ester

CAS Registry Number®

717-01-1

CAS Name

Benzoic acid, 3-hydroxy-4-nitro-, ethyl ester

Molecular Formula

C9H9NO5

Molecular Mass

211.17

Cite this Page

Benzoic acid, 3-hydroxy-4-nitro-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=717-01-1 (retrieved 2024-11-21) (CAS RN: 717-01-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    84 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9NO5/c1-2-15-9(12)6-3-4-7(10(13)14)8(11)5-6/h3-5,11H,2H2,1H3

InChIKey

InChIKey=VDARTPBFQUTSTO-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-hydroxy-4-nitro-, ethyl ester
  • Ethyl 3-hydroxy-4-nitrobenzoate
  • 3-Hydroxy-4-nitrobenzoic acid ethyl ester

CAS INSIGHTSTM
Targeted protein degrader structure, illustration