ChemicalBook CAS DataBase List 5836-10-2

5836-10-2

Name	CHLOROPROPYLATE
CAS	5836-10-2
EINECS(EC#)	227-421-4
Molecular Formula	C17H16Cl2O3
MDL Number	MFCD00078633
Molecular Weight	339.21
MOL File	5836-10-2.mol

Chemical Properties

Melting point	72.4°C
Boiling point	148～150℃ (0.5mmHg)
density	1.2775 (estimate)
pka	11.18±0.29(Predicted)
Water Solubility	10mg/L(room temperature)
Henry's Law Constant	1.2×10³ mol/(m³Pa) at 25℃, HSDB (2015)
InChI	InChI=1S/C17H16Cl2O3/c1-11(2)22-16(20)17(21,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-11,21H,1-2H3
InChIKey	AXGUBXVWZBFQGA-UHFFFAOYSA-N
SMILES	C(O)(C(=O)OC(C)C)(C1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1
EPA Substance Registry System	Chloropropylate (5836-10-2)

Safety Data

Hazard Codes	Xi
Risk Statements	41 less more
Safety Statements	26-39 less more
RTECS	DD2450000
HS Code	29181990
Hazardous Substances Data	5836-10-2(Hazardous Substances Data)

Hazard Information

Description

Chloropropylate is an obsolete insecticide. It has a low aqueous solubility and is not highly volatile. It has a low mammalian and fish ecotoxicity. Whilst it is considered to be a skin and eye irritant there is no data to suggest it would cause significant health implications unless doses are high.

Uses

Chloropropylate is a dichlorobenzylic acid derivative and a related compound of DDT. Chloropropylate is an aracicide used for mite control.

Uses

Chloropropylate is a dichlorobenzylic acid derivative and a related compound of DDT. Chloropropylate is an aracicide used for mite control.

Definition

ChEBI: Chloropropylate is an organochlorine acaricide, a member of monochlorobenzenes, a tertiary alcohol and an isopropyl ester. It has a role as a bridged diphenyl acaricide. It is functionally related to a 4,4'-dichlorobenzilic acid.

Production Methods

Chloropropylate was produced commercially through a synthesis involving halogenated aromatic compounds and esterification reactions. The process typically began with the preparation of 4-chlorobenzyl alcohol, which was then reacted with propionic acid or its derivatives under controlled conditions to form the ester compound, chloropropylate (4-chlorobenzyl propionate). This reaction was catalysed by acid or base catalysts and carried out in a solvent medium to ensure high yield and purity.

Mechanism of action

Specific with contact action. Inhibitor of oxidative phosphorylation. Inhibitor of mitochondrial ATP synthase.

Pesticide Type

Insecticide; Miticide

Supplier

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