Compound Identification
SMILES
CC1C(C)C2(C)CCC(O)CC2C(Br)C1=O
InChIKey
InChIKey=LIIFSZVNNQGFRU-UHFFFAOYSA-N
Formula
C13H21BrO2
Mass
289.213
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
- Level 6 Alpha-haloketones
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Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones
Direct Parent
Alpha-haloketones
Alternative Parents
Secondary alcohols Cyclic ketones Cyclic alcohols and derivatives Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Alpha-haloketone - Cyclic alcohol - Cyclic ketone - Secondary alcohol - Organic oxide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Alcohol - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha-haloketones. These are organic compounds contaning a halogen atom attached to the alpha carbon atom relative to C=O group.
External Descriptors
Not available