Structure Information
Structure

Compound Identification

SMILES

[SH-].[SH-].[SH-].[SH-].[SH-].[SH-].[SH-].[SH-].[SH-].[Fe].[Fe].[Fe].[Fe].[Fe].[Fe].[Mo].[Mo].C[PH+](C)CC[PH+](C)C.C[PH+](C)CC[PH+](C)C.C[PH+](C)CC[PH+](C)C.C[PH+](C)CC[PH+](C)C.C[PH+](C)CC[PH+](C)C.OC1=C(O)C(Cl)=C(Cl)C(Cl)=C1Cl.OC1=C(O)C(Cl)=C(Cl)C(Cl)=C1Cl

InChIKey

InChIKey=NURFTVCRQSJGDP-UHFFFAOYSA-O

Formula

C42H103Cl8Fe6Mo2O4P10S9

Mass

2081.13

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Benzenediols

Intermediate Tree Nodes

Catechols - Chlorocatechols

Direct Parent

4-chlorocatechols

Alternative Parents

3-chlorocatechols P-chlorophenols O-chlorophenols M-chlorophenols Chlorobenzenes Aryl chlorides Organic transition metal salts Organophosphorus compounds Organooxygen compounds Organochlorides Hydrocarbon derivatives Organic cations

Molecular Framework

Not available

Substituents

3-chlorocatechol - 4-chlorocatechol - 4-halophenol - 4-chlorophenol - 3-halophenol - 2-halophenol - 3-chlorophenol - 2-chlorophenol - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Organic transition metal salt - Organophosphorus compound - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organochloride - Organohalogen compound - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 4-chlorocatechols. These are chlorocatechols with the chlorine atom attached at position C4 of the benzene ring.

External Descriptors

Not available

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