Compound Identification
SMILES
CCOC(=O)C(=CNC1=C(F)C=C(O)C=C1)C#N
InChIKey
InChIKey=UHRWMDGRESPHBC-UHFFFAOYSA-N
Formula
C12H11FN2O3
Mass
250.229
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
-
Subclass
Halophenols
-
Level 5
Fluorophenols
- Level 6 M-fluorophenols
-
Level 5
Fluorophenols
-
Subclass
Halophenols
-
Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Halophenols
Intermediate Tree Nodes
Fluorophenols
Direct Parent
M-fluorophenols
Alternative Parents
p-Aminophenols Aniline and substituted anilines Fluorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Vinylogous amides Enoate esters Nitriles Monocarboxylic acids and derivatives Enamines Allylamines Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aminophenol - P-aminophenol - 3-fluorophenol - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Vinylogous amide - Carboxylic acid ester - Enamine - Carbonitrile - Monocarboxylic acid or derivatives - Nitrile - Allylamine - Carboxylic acid derivative - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as m-fluorophenols. These are fluorophenols carrying a iodine at the C3 position of the benzene ring.
External Descriptors
Not available