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25059-80-7

25059-80-7 Structure

25059-80-7 Structure
IdentificationMore
[Name]

Benazolin-ethyl
[CAS]

25059-80-7
[Synonyms]

3-N-ETHOXYCARBONYLMETHYL-4-CHLORO-BENZOTHIAZOL-2-ONE
4-chloro-2-oxo-3(2h)-benzothiazoleacetic acid
4-CHLORO-2-OXO-3(2H)-BENZOTHIAZOLEACETIC ACID ETHYL ESTER
4-chloro-2-oxo-benzothiazoleacetic acid ethyl ester
7-chloro-2-oxo-3(2h)-benzothiazolacetic acid
7-chloro-2-oxo-3(2h)-benzothiazoleacetic acid ethyl ester
BENAZOLIN-ETHYL
BENAZOLIN-ETHYL ESTER
ETHYL-4-CHLOR-2-OXO-BENZOTHIAZOLINACETAT
ethyl 4-chloro-2-oxo-3h-1,3-benzothiazole-3-ylacetate
4-chloro-2-oxo-3(2h)-benzothiazoleaceticaciethylester
4-chloro-2-oxo-3-benzothiazolineaceticaciethylester
ethyl4-chloro-2-oxo-3(2h)-benzothiazoleacetate
ethyl 4-chloro-2-oxo-2H-benzothiazole-3-acetate
BENZAZOLIN-ETHYL ESTER PESTANAL (ETHYL 4
Benazolin, ethyl ester salts
benazolin-ethyl ester (bsi,iso,wssa)
BENZAOLIN-ETHYLESTER
BENZOLIN-ETHYL
4-Chloro-2-oxo-3(2H)-benzothiazoleaceticacidethyester
[EINECS(EC#)]

246-591-0
[Molecular Formula]

C11H10ClNO3S
[MDL Number]

MFCD00143653
[Molecular Weight]

271.72
[MOL File]

25059-80-7.mol
Chemical PropertiesBack Directory
[Melting point ]

79°C
[Boiling point ]

408.1±55.0 °C(Predicted)
[density ]

1.418±0.06 g/cm3(Predicted)
[form ]

neat
[pka]

-2.57±0.20(Predicted)
[BRN ]

753659
[Henry's Law Constant]

4.7×102 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
[Major Application]

agriculture
environmental
[InChI]

1S/C11H10ClNO3S/c1-2-16-9(14)6-13-10-7(12)4-3-5-8(10)17-11(13)15/h3-5H,2,6H2,1H3
[InChIKey]

WQRCEBAZAUAUQC-UHFFFAOYSA-N
[SMILES]

CCOC(=O)CN1C(=O)Sc2cccc(Cl)c12
[Uses]

Agricultural chemical.
[CAS DataBase Reference]

25059-80-7(CAS DataBase Reference)
[EPA Substance Registry System]

25059-80-7(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

N
[Risk Statements ]

R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 3077 9/PG 3
[WGK Germany ]

2
[RTECS ]

DL0880000
[HS Code ]

29342000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Aquatic Chronic 2
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

Benazolin
Hazard InformationBack Directory
[Hazard]

Moderately toxic by ingestion and skin contact.
[Description]

Benazolin ethyl is a post-emergence herbicide. It has a moderate aqueous solubility, is volatile with a low tendency to leach to groundwater. It is not persistent in soil systems but may be persistent in water. Benazolin ethyl has a low mammalian toxicity and is not expected to bioaccumulation. It has a low toxicity to birds and is moderately toxicity to most aquatic organisms and earthworms.
[Definition]

ChEBI: The ethyl ester of benazolin. It is used as a post-emergence herbicide used (generally as a salt or ester) for the control of annual weeds in wheat and oilseed rape. It is not approved for use with the European Union.
[Production Methods]

Benazolin-ethyl is commercially synthesised through esterification of benazolin acid with ethanol. The production process begins with the preparation of benazolin acid, which involves the chlorination and cyclization of benzothiazole derivatives to form 4-chloro-2-oxo-3(2H)-benzothiazoleacetic acid. This intermediate is then esterified with ethanol in the presence of an acid catalyst to yield benazolin-ethyl. The reaction is typically conducted under reflux conditions to ensure complete conversion and high purity.
[Mechanism of action]

Selective, systemic growth-regulation action. Synthetic auxin.
[Pesticide Type]

Herbicide
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

25059-80-7(sigmaaldrich)
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