Compound Identification
SMILES
[Ti].CO.CC(C)(C)O.OC1=C(C2=CC=CC=C2C=C1Br)C1=C(O)C(Br)=CC2=CC=CC=C12
InChIKey
InChIKey=TUTZYCWTFVAWTI-UHFFFAOYSA-N
Formula
C25H26Br2O4Ti
Mass
598.154
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Biphenyls and derivatives
-
Level 5
Brominated biphenyls
- Level 6 Polybrominated biphenyls
-
Level 5
Brominated biphenyls
-
Subclass
Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Brominated biphenyls
Direct Parent
Polybrominated biphenyls
Alternative Parents
Naphthols and derivatives O-bromophenols Aryl bromides Tertiary alcohols Organic transition metal salts Primary alcohols Organobromides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Polybrominated biphenyl - 2-naphthol - Naphthalene - 2-halophenol - 2-bromophenol - Phenol - Aryl bromide - Aryl halide - Tertiary alcohol - Organic transition metal salt - Organohalogen compound - Organooxygen compound - Primary alcohol - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organobromide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as polybrominated biphenyls. These are organic aromatic compounds containing a biphenyl moiety, which is substituted at two or more ring positions by a bromine atom.
External Descriptors
Not available