Ethyl (4-nitrobenzoyl)acetate

CAS Registry Number®

838-57-3

CAS Name

Ethyl (4-nitrobenzoyl)acetate

Molecular Formula

C11H11NO5

Molecular Mass

237.21

Cite this Page

Ethyl (4-nitrobenzoyl)acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=838-57-3 (retrieved 2024-11-22) (CAS RN: 838-57-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    73-74 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H11NO5/c1-2-17-11(14)7-10(13)8-3-5-9(6-4-8)12(15)16/h3-6H,2,7H2,1H3

InChIKey

InChIKey=NGRXSVFCLHVGKU-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenepropanoic acid, 4-nitro-β-oxo-, ethyl ester
  • Acetic acid, (p-nitrobenzoyl)-, ethyl ester
  • Ethyl (p-nitrobenzoyl)acetate
  • (p-Nitrobenzoyl)acetic acid ethyl ester
  • Ethyl (4-nitrobenzoyl)acetate

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