Ethyl 4-(2-formyl-1H-pyrrol-1-yl)benzoate

CAS Registry Number®

86454-37-7
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CAS Name

Ethyl 4-(2-formyl-1H-pyrrol-1-yl)benzoate

Molecular Formula

C14H13NO3

Molecular Mass

243.26

Cite this Page

Ethyl 4-(2-formyl-1H-pyrrol-1-yl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=86454-37-7 (retrieved 2024-08-05) (CAS RN: 86454-37-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    70-72 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C14H13NO3/c1-2-18-14(17)11-5-7-12(8-6-11)15-9-3-4-13(15)10-16/h3-10H,2H2,1H3

InChIKey

InChIKey=ADNPMYNBUFWURJ-UHFFFAOYSA-N

SMILES

C(=O)C=1N(C=CC1)C2=CC=C(C(OCC)=O)C=C2

Canonical SMILES

O=CC1=CC=CN1C2=CC=C(C=C2)C(=O)OCC

Other Names for this Substance

  • Benzoic acid, 4-(2-formyl-1H-pyrrol-1-yl)-, ethyl ester
  • Ethyl 4-(2-formyl-1H-pyrrol-1-yl)benzoate