2,4-DICHLOROPHENACYL CHLORIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H5Cl3O
Molecular Weight	223.484
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,4-DICHLOROPHENACYL CHLORIDE

Structure Search

SMILES

ClCC(=O)C1=C(Cl)C=C(Cl)C=C1

InChI

InChIKey=VYWPPRLJNVHPEU-UHFFFAOYSA-N

InChI=1S/C8H5Cl3O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H2

HIDE SMILES / InChI

Molecular Formula	C8H5Cl3O
Molecular Weight	223.484
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/1007319 | https://www.ncbi.nlm.nih.gov/pubmed/22884108

2,4-dichlorophenacyl chloride is a metabolite of the alkenyl phosphate insecticides dimethylvinphos and chlorfenvinphos. 2,4-dichlorophenacyl chloride is a reagent used in the synthesis of isoconazole, a potent antifungal agent.

Originator

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

PubMed

Title	Date	PubMed
The metabolism of 2-chloro-1-(2',4'-dichlorophenyl)vinyl diethyl phosphate (Chlorfenvinphos) in the dog and rat.	1967 Jan	6030274
Metabolic demethylation of the insecticide dimethylvinphos in rats, in dogs, and in vitro.	1976 Dec	1007319
Design, synthesis and evaluation of clinafloxacin triazole hybrids as a new type of antibacterial and antifungal agents.	2012 Sep 1	22884108

Patents

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:59:54 GMT 2023` Edited by `admin` on `Fri Dec 15 17:59:54 GMT 2023`
Record UNII	2E35P7HJI2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4-DICHLOROPHENACYL CHLORIDE

Systematic Name

English

ETHANONE, 2-CHLORO-1-(2,4-DICHLOROPHENYL)-

Systematic Name

English

TRICHLOROACETOPHENONE, 2,2',4'-

Systematic Name

English

.ALPHA.,2,4-TRICHLOROACETOPHENONE

Systematic Name

English

CHLOROMETHYL 2,4-DICHLOROPHENYL KETONE

Systematic Name

English

2,2',4'-TRICHLOROACETOPHENONE

Systematic Name

English

Code System Code Type Description

PUBCHEM

20250