Compound Identification
SMILES
CCN(CC)CC1=C(C)C2=C(C3=CC(Br)=C(O)C(Br)=C3)C3=CC=CC=C3C(Br)=C2S1
InChIKey
InChIKey=YJSKKYXMKLNJHQ-UHFFFAOYSA-N
Formula
C24H22Br3NOS
Mass
612.22
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
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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
Naphthothiophenes 1-benzothiophenes O-bromophenols Bromobenzenes Aralkylamines Aryl bromides Thiophenes Heteroaromatic compounds Trialkylamines Organooxygen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Polybrominated biphenyl - Naphthothiophene - Naphthalene - 1-benzothiophene - Benzothiophene - 2-bromophenol - 2-halophenol - Aralkylamine - Bromobenzene - Phenol - Halobenzene - Aryl bromide - Aryl halide - Heteroaromatic compound - Thiophene - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Organobromide - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic 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