Compound Identification
SMILES
ClC1=CC(Cl)=C(C(=O)P(=O)(C2=CC=CC=C2)C2=CC=CC=C2)C(Cl)=C1.COC1=CC(OC)=C(C(=O)P(C2=CC=CC=C2)C2=CC=CC=C2)C(OC)=C1
InChIKey
InChIKey=YNUPJZOBRGXKAY-UHFFFAOYSA-N
Formula
C41H33Cl3O6P2
Mass
790.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Halobenzoic acids and derivatives
Direct Parent
4-halobenzoic acids and derivatives
Alternative Parents
2-halobenzoic acids and derivatives Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Phenylphosphines and derivatives Chlorobenzenes Alkyl aryl ethers Aryl chlorides Vinylogous halides Organic phosphines and derivatives Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
4-halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Benzoyl - Alkyl aryl ether - Phenylphosphine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Vinylogous halide - Phosphine - Ether - Organohalogen compound - Organochloride - Organooxygen compound - Organophosphorus compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
External Descriptors
Not available