Compound Identification
SMILES
BrCC(=O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=QBXCVQVFPVXAGS-UHFFFAOYSA-N
Formula
C9H7BrO3
Mass
243.056
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Aryl alkyl ketones Benzenoids Alpha-haloketones Oxacyclic compounds Acetals Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Aryl ketone - Aryl alkyl ketone - Benzenoid - Alpha-haloketone - Ketone - Acetal - Oxacycle - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Alkyl halide - Hydrocarbon derivative - Alkyl bromide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available