Ethyl 2-nitro-β-oxobenzenepropanoate

CAS Registry Number®

52119-39-8
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CAS Name

Ethyl 2-nitro-β-oxobenzenepropanoate

Molecular Formula

C11H11NO5

Molecular Mass

237.21

Cite this Page

Ethyl 2-nitro-β-oxobenzenepropanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=52119-39-8 (retrieved 2024-04-29) (CAS RN: 52119-39-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    170 °C @ Press: 0.1 Torr
  • Melting Point (2)

    35-36 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=OWZNCVIBJQPNEF-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OCC)CC(=O)C=1C=CC=CC1N(=O)=O

Other Names for this Substance

  • Benzenepropanoic acid, 2-nitro-β-oxo-, ethyl ester
  • Acetic acid, (o-nitrobenzoyl)-, ethyl ester
  • Ethyl 2-nitro-β-oxobenzenepropanoate
  • (o-Nitrobenzoyl)acetic acid ethyl ester
  • Ethyl (2-nitrobenzoyl)acetate

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