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Thifluzamide

CAT: 1410-M20528-02Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M20528-02Size:1 mL x 10 mM in DMSO
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Description
Thifluzamide is a fungicide widely used to control crop diseases.
CAS Number
130000-40-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
528.06
Molecular Formula
C13H6Br2F6N2O2S
Notes
Research use only, not for human use.
Receptor
Antifungal

Chemical Information

Thifluzamide

Thifluzamide is an aromatic amide obtained by formal condensation of the carboxy group of 2-methyl-4-(trifluoromethyl)thiazole-5-carboxylic acid with the amino group of 2,6-dibromo-4-(trifluoromethoxy)aniline. Used to control Rhizoctonia spp. diseases on rice, potatoes, maize, grass and other crops. It has a role as an EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor and an antifungal agrochemical. It is an aromatic ether, an organofluorine compound, a dibromobenzene, a member of 1,3-thiazoles, an aromatic amide and an anilide fungicide.

CAS Number130000-40-7
PubChem CID86389
IUPAC NameN-[2,6-dibromo-4-(trifluoromethoxy)phenyl]-2-methyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
Molecular FormulaC13H6Br2F6N2O2S
Molecular Weight528.06
XLogP6
Topological Polar Surface Area79.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity512
SMILES
CC1=NC(=C(S1)C(=O)NC2=C(C=C(C=C2Br)OC(F)(F)F)Br)C(F)(F)F
InChI
InChI=1S/C13H6Br2F6N2O2S/c1-4-22-10(12(16,17)18)9(26-4)11(24)23-8-6(14)2-5(3-7(8)15)25-13(19,20)21/h2-3H,1H3,(H,23,24)
InChIKey
WOSNCVAPUOFXEH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thifluzamide
CAS: 130000-40-7
CID: 86389
Formula: C13H6Br2F6N2O2S
MW: 528.06
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight528.06
XLogP36
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count3
Exact Mass527.84004
Monoisotopic Mass525.84209
Topological Polar Surface Area79.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity512
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
561570Thifluzamide
HY-B2004R-01Thifluzamide (Standard)
CS-T-103560Thifluzamide-d3

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