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131983-72-7

131983-72-7 Structure

131983-72-7 Structure
IdentificationBack Directory
[Name]

TRITICONAZOLE
[CAS]

131983-72-7
[Synonyms]

REAL
ALIOS
PREMIS
TRITICONAZOLE
Tririconazole
Triticonazole [iso]
Triticonazole Standard
triticonazole (bsi,pa e-iso)
TriticonazoleSolution,10mg/L,10ml
TRITICONAZOLE, 10 UG/ML IN ISOOCTANE
Triticonazole@100 μg/mL in Acetonitrile
Triticonazole@1000 μg/mL in Acetonitrile
(E)-5-(4-Chlorobenzylidene)-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)cyclopentanol
Cyclopentanol, 5-4-chlorophenyl)methylene-2,2-dimethyl-1-(1H-1,2,4-triazol-1-ylmethyl)-
(Z)-1-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-chlorobenzylidene)-2,2-dimethylcyclopentanol
(rs)-(e)-5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1h-1,2,4-triazol-1-ylmethyl)cyclopentanol
[Molecular Formula]

C17H20ClN3O
[MDL Number]

MFCD01632360
[MOL File]

131983-72-7.mol
[Molecular Weight]

317.81
Chemical PropertiesBack Directory
[Melting point ]

143~149℃
[Boiling point ]

498.7±55.0 °C(Predicted)
[density ]

1.23±0.1 g/cm3(Predicted)
[storage temp. ]

0-6°C
[solubility ]

DMF: 30 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml; Ethanol:PBS(pH 7.2) (1:1): 0.5 mg/ml
[form ]

neat
[pka]

13.23±0.40(Predicted)
[Henry's Law Constant]

6.6×104 mol/(m3Pa) at 25℃, HSDB (2015)
[Major Application]

agriculture
environmental
[InChI]

1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+
[InChIKey]

PPDBOQMNKNNODG-NTEUORMPSA-N
[SMILES]

CC1(C)CCC(=C/c2ccc(Cl)cc2)\C1(O)Cn3cncn3
[EPA Substance Registry System]

Triticonazole (131983-72-7)
Safety DataBack Directory
[Hazard Codes ]

N
[Risk Statements ]

51/53
[Safety Statements ]

61
[RIDADR ]

UN3077 9/PG 3
[WGK Germany ]

2
[RTECS ]

GY4705000
[HS Code ]

29339900
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Aquatic Acute 1
Aquatic Chronic 1
Repr. 2
STOT RE 2
[Hazardous Substances Data]

131983-72-7(Hazardous Substances Data)
Hazard InformationBack Directory
[Uses]

Agricultural chemical.
[Definition]

ChEBI: (5E)-5-(4-chlorobenzylidene)-2,2-dimethyl-1-(1,2,4-triazol-1-ylmethyl)cyclopentanol is a member of the class of cyclopentanols carrying 1,2,4-triazol-1-ylmethyl and 4-chlorobenzylidene and geminal dimethyl substituents at positions 1, 2 and 5 respectively. It is a member of triazoles, a member of monochlorobenzenes, a member of cyclopentanols, a tertiary alcohol and an olefinic compound.
[Production Methods]

Triticonazole is commercial production involves multi-step organic synthesis, typically starting from a substituted cyclopentanone derivative. The process includes the formation of a triazole ring system and the introduction of a chlorophenylmethylene moiety through condensation reactions. The final product, a crystalline solid, is purified to a high degree and formulated.
[Hazard]

A reproductive hazard.
[Agricultural Uses]

Fungicide, Seed disinfectant: Used as a biocide in water-treatment facilities. Turf and seed protectant and treatment for grains, cereals, forage, fodder, straw, corn, barley, wheat to prevent rusts, powdery mildew and other pathogens. Registered for use in EU countries . Registered for use in the U.S. U.S. Maximum Allowable Residue Levels for the fungicide triticonazole from the treatment of seed prior to planting
[Trade name]

ALIOS®; CHARTER F2 FUNGICIDE SEED TREATMENT®; CHARTER FUNGICIDE SEED TREATMENT®; CHARTER PB FUNGICIDE SEED TREATMENT®; FUNGUS CLEAR ULTRA®; KINTO®; PREMIS 25 FS®; REAL®; RESERVE FUNGICIDE®; STAMINA F3 HL FUNGICIDE SEED TREATMENT®; STAMINA F3 RTU FUNGICIDE SEED TREATMENT®; TRITICONAZOLE CONCENTRATE FUNGICIDE®; TRITICONAZOLE 3 SC FUNGICIDE®; TRITICONAZOLE SC FUNGICIDE®; TRITICONAZOLE HL FUNGICIDE SEED TREATMENT®; TRITICONAZOLE 70 WDG FUNGICIDE®; TRITICONAZOLE TECHNICAL FUNGICIDE®
[Mechanism of action]

Inhibits sterol demethylation. Sterol biosynthesis inhibitor.
[storage]

Store at -20°C
[Pesticide Type]

Fungicide
Spectrum DetailBack Directory
[Spectrum Detail]

TRITICONAZOLE(131983-72-7)1HNMR
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