CHEBI:59978 - pyrrole-2-carboxaldehyde

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pyrrole-2-carboxaldehyde
ChEBI ID CHEBI:59978
Definition A pyrrole carrying a formyl substituent at the 2-position.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C5H5NO
Net Charge 0
Average Mass 95.09930
Monoisotopic Mass 95.03711
InChI InChI=1S/C5H5NO/c7-4-5-2-1-3-6-5/h1-4,6H
InChIKey ZSKGQVFRTSEPJT-UHFFFAOYSA-N
SMILES [H]C(=O)c1ccc[nH]1
ChEBI Ontology
Outgoing pyrrole-2-carboxaldehyde (CHEBI:59978) is a 1,3-thiazole-2-carbaldehyde (CHEBI:43623)
pyrrole-2-carboxaldehyde (CHEBI:59978) is a pyrroles (CHEBI:26455)
IUPAC Name
1H-pyrrole-2-carbaldehyde
Synonyms Sources
1(H)-pyrrole carboxaldehyde NIST Chemistry WebBook
1-Pyrrole-2-carboxaldehyde NIST Chemistry WebBook
1H-Pyrrole-2-carboxaldehyde ChemIDplus
1H-pyrrole-2-carboxyaldehyde NIST Chemistry WebBook
2-carboxaldehyde-1H-pyrrole NIST Chemistry WebBook
2-Formylpyrrole ChemIDplus
2-Pyrrolaldehyde NIST Chemistry WebBook
2-Pyrrolcarbaldehyde NIST Chemistry WebBook
2-pyrrole aldehyde ChEBI
2-Pyrrolecarbaldehyde ChemIDplus
2-Pyrrolecarboxaldehyde NIST Chemistry WebBook
2-Pyrrolylcarboxaldehyde ChemIDplus
α-Pyrrolaldehyde NIST Chemistry WebBook
Pyrrol-2-carboxaldehyde NIST Chemistry WebBook
Pyrrole-2-aldehyde ChemIDplus
pyrrole-2-carbaldehyde NIST Chemistry WebBook
Registry Numbers Types Sources
1003-29-8 CAS Registry Number NIST Chemistry WebBook
1003-29-8 CAS Registry Number ChemIDplus
105745 Reaxys Registry Number Reaxys
105745 Beilstein Registry Number Beilstein
49889 Gmelin Registry Number Gmelin
Citations Waiting for Citations Types Sources
1556177 PubMed citation Europe PMC
17430038 PubMed citation Europe PMC
28575820 PubMed citation Europe PMC
2917974 PubMed citation Europe PMC
Last Modified
23 August 2017