3-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid
CAS Registry Number®
26180-28-9
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CAS Name
3-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acidMolecular Formula
C13H13NO2Molecular Mass
215.25Cite this Page
3-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=26180-28-9 (retrieved ) (CAS RN: 26180-28-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
146 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H13NO2/c1-9-6-7-10(2)14(9)12-5-3-4-11(8-12)13(15)16/h3-8H,1-2H3,(H,15,16)
InChIKey
InChIKey=NJPUZFUOUGTNOV-UHFFFAOYSA-N
SMILES
CC=1N(C(C)=CC1)C2=CC(C(O)=O)=CC=C2
Canonical SMILES
O=C(O)C1=CC=CC(=C1)N2C(=CC=C2C)C
Other Names for this Substance
- Benzoic acid, 3-(2,5-dimethyl-1H-pyrrol-1-yl)-
- Benzoic acid, m-(2,5-dimethylpyrrol-1-yl)-
- 3-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid
- 3-(2,5-Dimethylpyrrol-1-yl)benzoic acid
- C 128773
