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ChemicalBook--->CAS DataBase List--->83657-24-3

83657-24-3

83657-24-3 Structure

83657-24-3 Structure
IdentificationMore
[Name]

Diniconazole
[CAS]

83657-24-3
[Synonyms]

ACIDAN
ALYANS
DINICONAZOL
DINICONAZOLE
DINIT
DINIZOL
(e)-1-(2,4,-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazole-1-yl)1-pentenyl-3-ol
MITAZOLE
SPOTLESS
(e)-(+-)-imethylethyl)
1h-1,2,4-triazole-1-ethanol,beta-((2,4-dichlorophenyl)methylene)-alpha-(1,1-d
diniconazole(stereochemistryunspecified)
orthospotless
s-3308-10
s-3308l
sumi-8
xe-779l
DINICONAZOL MIXTURE OF Z AND E ISOMERS, PESTANAL, 250 MG
DINIXONAZOLE
diniconazole (ansi,bsi, draft-iso)
[Molecular Formula]

C15H17Cl2N3O
[MDL Number]

MFCD01678675
[Molecular Weight]

326.22
[MOL File]

83657-24-3.mol
Chemical PropertiesBack Directory
[Melting point ]

134~156℃
[Boiling point ]

501.1±60.0 °C(Predicted)
[density ]

1.32
[vapor pressure ]

2.93 x l0-3 Pa (20 °C)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

DMSO:100.0(Max Conc. mg/mL);306.54(Max Conc. mM)
Water:0.67(Max Conc. mg/mL);2.05(Max Conc. mM)
[form ]

A solid
[pka]

12.89±0.20(Predicted)
[Water Solubility ]

4 mg l-1 (25 °C)
[color ]

White to off-white
[CAS DataBase Reference]

83657-24-3(CAS DataBase Reference)
[EPA Substance Registry System]

83657-24-3(EPA Substance)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Potassium carbonate-->Hydrazinium hydroxide solution-->Potassium borohydride-->olefine ketone-->2,4-Dichlorobenzaldehyde-->3-Amino-5-mercapto-1,2,4-triazole-->3,3-Dimethyl-1-(1,2,4-triazole-1-yl)-2-butanone-->1-Chloropinacolone
[Preparation Products]

Carbendazim+Diniconazole,W.P.-->Validamycin+Diniconazole,W.P.
Hazard InformationBack Directory
[Uses]

Diniconazole is used to control leaf and ear diseases in cereals, powdery mildew in vines, rust and black spot in roses, leaf spot in peanuts, Sigatoka disease in bananas, and Uredinales in coffee. It is also used on fruit, vegetables and ornamentals.
[Definition]

ChEBI: (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol is a member of the class of triazoles that is 4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol substituted at position 1 by a 2,4-dichlorophenyl group. It is a dichlorobenzene, an olefinic compound, a secondary alcohol and a member of triazoles.
[Metabolic pathway]

Diniconazole is a mixture of four isomers, which are derived from a chiral carbon atom and a double bond in the molecule. Diniconazole M [( E)-( S)-1-(2 ,4-dichlorophenyl)-4,4-dimethyl-2-1(H -1,2,4-triazol-l-yl)pent- 1-en-3-ol] is more potent than diniconazole. The major metabolic pathways of diniconazole involve oxidative attack on the pentenol side chain to give products which may form conjugates. In mammals, sulfurcontaining metabolites may be formed.
[storage]

Store at -20°C
[Degradation]

Diniconazole is stable to heat, light and moisture. It undergoes photolysis and irradiation of a solution in methanol with light from a high-pressure mercury lamp for 8 hours gave three major and seven minor products, 2- 11 (Scheme 1). The major photoproduct was identified as the 2-isomer (2). The other major products (5 and 6) were formed by photooxidation of the CHOH group to a carbonyl group.
When diniconazole was irradiated as a thin film under ultraviolet light (254 nm), the major product was identified as the Z-isomer. On the surface of a sandy loam soil, under the same irradiation conditions rapid degradation occurred with the formation of 2, 5 and 6. A thin film of diniconazole applied to a glass plate degraded very slowly in the dark. When the plate was placed in the sunhght, 70% of the applied material disappeared after 5 days exposure and isomerisation occurred to give the Z-isomer (65%). The DT50 in sunlight was 2.5 days. Under ultraviolet light (254 mn), the Z-isomer was formed after 15 minutes irradiation, and after 5 hours 90% of the material had isomerised (Dureja and Walia, 1992).
Safety DataBack Directory
[Toxicity]

LD50 in male, female rats (mg/kg): 639, 474 orally; >5000, >5000 dermally (Takano)
Spectrum DetailBack Directory
[Spectrum Detail]

Diniconazole(83657-24-3)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

83657-24-3(sigmaaldrich)
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