Compound Identification
SMILES
COC1=C2OP(=S)(NC(C)C3=CC=CC=C3)OC3=C(OC)C=C(CC=C)C(Br)=C3C2=C(Br)C(CC=C)=C1
InChIKey
InChIKey=NDBWJXYKTPHDBL-UHFFFAOYSA-N
Formula
C28H28Br2NO4PS
Mass
665.38
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
Anisoles Alkyl aryl ethers Thiophosphoric acid esters Aryl bromides Oxacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Polybrominated biphenyl - Anisole - Alkyl aryl ether - Aryl bromide - Aryl halide - Thiophosphoric acid ester - Organic thiophosphoric acid or derivatives - Ether - Organoheterocyclic compound - Oxacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - 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