Compound Identification
SMILES
CC(C)C1=CC(OCC=C(Br)Br)=CC(F)=C1O
InChIKey
InChIKey=LWSCIRVEHPZWRV-UHFFFAOYSA-N
Formula
C12H13Br2FO2
Mass
368.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cumenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cumenes
Intermediate Tree Nodes
Not available
Direct Parent
Cumenes
Alternative Parents
Phenylpropanes 4-alkoxyphenols Phenoxy compounds Phenol ethers O-fluorophenols Fluorobenzenes Alkyl aryl ethers Aryl fluorides Ketene acetals Vinyl bromides Bromoalkenes Organofluorides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
4-alkoxyphenol - Phenylpropane - Cumene - Phenoxy compound - Phenol ether - 2-fluorophenol - 2-halophenol - Phenol - Halobenzene - Fluorobenzene - Alkyl aryl ether - Aryl halide - Aryl fluoride - Ketene acetal or derivatives - Bromoalkene - Haloalkene - Vinyl halide - Vinyl bromide - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors
Not available