2,4-Dimethyl-1H-pyrrole-3-propanoic acid

CAS Registry Number®

54474-50-9
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CAS Name

2,4-Dimethyl-1H-pyrrole-3-propanoic acid

Molecular Formula

C9H13NO2

Molecular Mass

167.21

Cite this Page

2,4-Dimethyl-1H-pyrrole-3-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54474-50-9 (retrieved 2024-07-07) (CAS RN: 54474-50-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    140-141 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H13NO2/c1-6-5-10-7(2)8(6)3-4-9(11)12/h5,10H,3-4H2,1-2H3,(H,11,12)

InChIKey

InChIKey=SAGABBLUUSFKNW-UHFFFAOYSA-N

SMILES

C(CC(O)=O)C=1C(C)=CNC1C

Canonical SMILES

O=C(O)CCC=1C(=CNC1C)C

Other Names for this Substance

  • 1H-Pyrrole-3-propanoic acid, 2,4-dimethyl-
  • Pyrrole-3-propionic acid, 2,4-dimethyl-
  • 2,4-Dimethyl-1H-pyrrole-3-propanoic acid
  • 3-(2,4-Dimethyl-1H-pyrrol-3-yl)propionic acid