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Fluquinconazole

CAT: 0013-GTR19242223-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19242223-02Size:10 mg
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Description
Fluquinconazole, marketed as Jockey in Australia, is a fungicidal seed treatment. This small molecule is used in agricultural research to study its in vitro and in vivo efficacy against fungal pathogens in crops.
CAS Number
136426-54-5
Smiles
O=C1C=2C=C (F) C=CC2N=C (N3N=CN=C3) N1C4=CC=C (Cl) C=C4Cl
Molecular Formula
C16H8Cl2FN5O
Molecular Weight
376.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Fluquinconazole

Fluquinconazole is a member of the class of quinazolines that is 6-fluoroquinazolin-4-one carrying additional 1,2,4-triazol-1-yl and 2,4-dichlorophenyl substituents at positions 2 and 3 respectively. A fungicide used to control Ascomycetes, Deuteromycetes and Basidiomycetes spp. on cereals, beets and fruit. It has a role as an EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor and an antifungal agrochemical. It is a dichlorobenzene, a member of triazoles, an organofluorine compound, a member of quinazolines, a conazole fungicide and a triazole fungicide.

CAS Number136426-54-5
PubChem CID86417
IUPAC Name3-(2,4-dichlorophenyl)-6-fluoro-2-(1,2,4-triazol-1-yl)quinazolin-4-one
Molecular FormulaC16H8Cl2FN5O
Molecular Weight376.2
XLogP4
Topological Polar Surface Area63.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity565
SMILES
C1=CC2=C(C=C1F)C(=O)N(C(=N2)N3C=NC=N3)C4=C(C=C(C=C4)Cl)Cl
InChI
InChI=1S/C16H8Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8H
InChIKey
IJJVMEJXYNJXOJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fluquinconazole
CAS: 136426-54-5
CID: 86417
Formula: C16H8Cl2FN5O
MW: 376.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight376.2
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass375.0089934
Monoisotopic Mass375.0089934
Topological Polar Surface Area63.4 Ų
Heavy Atom Count25
Formal Charge0
Complexity565
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
sc-228129BFluquinconazole
P01446AFluquinconazole [CAS:136426-54-5] 100ug/ml in Acetone
S-6103-ACN1000 ug/mL Fluquinconazole in Acetonitrile Volume: 1mL Ampule - 1ML

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