5-Methyl-2-nitrobenzeneacetic acid

CAS Registry Number®

37777-81-4
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CAS Name

5-Methyl-2-nitrobenzeneacetic acid

Molecular Formula

C9H9NO4

Molecular Mass

195.17

Cite this Page

5-Methyl-2-nitrobenzeneacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=37777-81-4 (retrieved 2024-09-06) (CAS RN: 37777-81-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    149 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9NO4/c1-6-2-3-8(10(13)14)7(4-6)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)

InChIKey

InChIKey=SKFYNOGBJGWWOB-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CC1=CC(=CC=C1N(=O)=O)C

Other Names for this Substance

  • Benzeneacetic acid, 5-methyl-2-nitro-
  • 5-Methyl-2-nitrobenzeneacetic acid
  • (5-Methyl-2-nitrophenyl)acetic acid
  • 2-(5-Methyl-2-nitrophenyl)acetic acid