Compound Identification
SMILES
CC1=CN=C(OC(F)(F)F)C(CBr)=C1C=O
InChIKey
InChIKey=BNBQLMKJMRUVHX-UHFFFAOYSA-N
Formula
C9H7BrF3NO2
Mass
298.059
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids and derivatives
Alternative Parents
Pyridine carboxaldehydes Polyhalopyridines O-alkylpyrimidines Aryl-aldehydes 2-halopyridines Heteroaromatic compounds Trihalomethanes Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Alkyl fluorides Alkyl bromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridine carboxylic acid or derivatives - O-alkylpyrimidine - Polyhalopyridine - 4-pyridine carboxaldehyde - 2-halopyridine - Aryl-aldehyde - Heteroaromatic compound - Trihalomethane - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Halomethane - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Alkyl bromide - Aldehyde - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof.
External Descriptors
Not available