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ChemicalBook--->CAS DataBase List--->3813-05-6

3813-05-6

3813-05-6 Structure

3813-05-6 Structure
IdentificationMore
[Name]

Benazolin
[CAS]

3813-05-6
[Synonyms]

(4-CHLORO-2-OXOBENZOTHIAZOLIN-3-YL)ACETIC ACID
BENAZOLIN
CRESOPUR
KEROPUR
(4-chloro-2-oxobenzothiazol-3-yl)-aceticaci
4-chloro-2-oxo-3(2h)-benzothiazoleaceticaci
4-chloro-2-oxo-3-benzothiazolineaceticaci
4-chloro-2-oxo-3-benzothiazolineaceticacid
4-chloro-2-oxobenzothiazol-3-ylaceticacid
ben-30
benasalox
benazalox
benazoline
ben-cornox
benopan
bensecal
benzar
chamilox
cornoxcwk
eunasin
[EINECS(EC#)]

223-297-0
[Molecular Formula]

C9H6ClNO3S
[MDL Number]

MFCD00057102
[Molecular Weight]

243.67
[MOL File]

3813-05-6.mol
Chemical PropertiesBack Directory
[Melting point ]

192-196°C
[Boiling point ]

468.4±55.0 °C(Predicted)
[density ]

1.3274 (rough estimate)
[refractive index ]

1.6300 (estimate)
[Fp ]

100 °C
[storage temp. ]

0-6°C
[pka]

3.50±0.10(Predicted)
[color ]

White, crystalline solid
[Water Solubility ]

0.6g/L(20 ºC)
[CAS DataBase Reference]

3813-05-6(CAS DataBase Reference)
[EPA Substance Registry System]

3813-05-6(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi;N,N,Xi
[Risk Statements ]

R36/38:Irritating to eyes and skin .
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S22:Do not breathe dust .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 3077
[RTECS ]

AF9700000
[HS Code ]

29342000
[Toxicity]

LD50 orl-rat: 3000 mg/kg 85ARAE 2,26,77
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethyl chloroformate-->Ammonium thiocyanate-->2-Chloroaniline-->SURFACTANT-->1-(2-Chlorophenyl)-2-thiourea-->2-AMINO-4-CHLOROBENZOTHIAZOLE-->Benazolin-ethyl
Hazard InformationBack Directory
[Uses]

Benazolin is a selective systemic herbicide developed in the 1960s that has growth-regulatory action in susceptible plants. Structurally, it is a benzothiazolacetic acid and is unrelated to the four major groups of synthetic auxins discussed thus far. Benazolin controls a range of annual broadleaf weeds in alfalfa (Medicago sativa), canola (Brassica spp.), cereals, clover (Trifolium spp.), corn (Zea mays), grassland, and flax (Linum usitatissimum), and it has a relatively low persistence in the environment.
[Definition]

ChEBI: A member of the class of benzothiazoles that is 4-chloro-1,3-benzothiazol-2(3H)-one which is substituted on the nitrogen by a carboxymethyl group and at position 4 by chlorine. A post-emergence herbicide used (generally as a salt or este ) for the control of annual weeds in wheat and oilseed rape. It is not approved for use with the European Union.
[Safety Profile]

Moderately toxic by ingestion. Anherbicide. When heated to decomposition it emits toxicfumes of SOx, Cl-, and NOx.
[Metabolism]

Because benazolin is not degraded by light and is not readily volatilized, the most important factors affecting its persistence in the environment are microbial breakdown and leaching. However, because the microbial breakdown is so rapid, significant leaching may not occur unless the rainfall within a few days of application is large.
[Toxicity evaluation]

Benazolin is primarily excreted in the urine as N-[2-chloro-6-(methylsulfinyl)phenyl]glycine and N-[N-[2-chloro-6-(methylthio)phenyl]glycinyl]aniline. Acid-labile conjugates of benazolin acid and N-[2-chloro- 6-(methylthio)phenylglycine] are also formed in small amounts. The acute oral LD50 for rat and mice are >5000 mg/kg and >4000 mg/kg, respectively. See Table 21 for a list of toxicological data for benazolin.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

3813-05-6(sigmaaldrich)
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