3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid

CAS Registry Number®

2386-33-6

CAS Name

3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid

Molecular Formula

C9H11NO3

Molecular Mass

181.19

Cite this Page

3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2386-33-6 (retrieved 2024-11-28) (CAS RN: 2386-33-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    204 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H11NO3/c1-4-5(2)10-8(9(12)13)7(4)6(3)11/h10H,1-3H3,(H,12,13)

InChIKey

InChIKey=PPSGKMWFWAXDHT-UHFFFAOYSA-N

SMILES

C(C)(=O)C1=C(C(O)=O)NC(C)=C1C

Canonical SMILES

O=C(O)C=1NC(=C(C1C(=O)C)C)C

Other Names for this Substance

  • 1H-Pyrrole-2-carboxylic acid, 3-acetyl-4,5-dimethyl-
  • Pyrrole-2-carboxylic acid, 3-acetyl-4,5-dimethyl-
  • 3-Acetyl-4,5-dimethyl-1H-pyrrole-2-carboxylic acid

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