Fluvalinate

Base Information

• Chemical Name: Fluvalinate
• CAS No.: 69409-94-5
• Deprecated CAS: 79472-91-6
• Molecular Formula: C₂₆H₂₂ClF₃N₂O₃
• Molecular Weight: 502.92
• European Community (EC) Number: 805-993-1
• UN Number: 2902
• UNII: 364G5G03VC
• DSSTox Substance ID: DTXSID7024110
• Nikkaji Number: J18.831J
• Wikipedia: Fluvalinate
• Wikidata: Q408440
• NCI Thesaurus Code: C79673
• ChEMBL ID: CHEMBL3185183
• Mol file: 69409-94-5.mol

Synonyms:alpha-cyano-3-phenoxybenzyl 2-(2-chloro-4-trifluoromethylanilino)-3-methylbutanoate;fluvalinate;Mavrik

Chemical Property of Fluvalinate

Chemical Property:

• Melting Point: <25 °C
• Boiling Point: 566.2 ºC at 760 mmHg
• PKA: -1.16±0.50(Predicted)
• Flash Point: 296.2 ºC
• PSA: 71.35000
• Density: 1.312 g/cm3
• LogP: 7.46868
• Storage Temp.: 0-6°C
• XLogP3: 7.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 502.1271047
• Heavy Atom Count: 35
• Complexity: 735
• Transport DOT Label: Poison

Purity/Quality:

99.9% ^*data from raw suppliers

FLUVALINATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Pesticides -> Pyrethrins/Pyrethroids
• Canonical SMILES: CC(C)C(C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)NC3=C(C=C(C=C3)C(F)(F)F)Cl
• Description: Fluvalinate is a viscous amber oil with a moderate or weak sweetish odor (technical grade)
• Uses: Insecticide. Fluvalinate is a pesticide.

Technology Process of Fluvalinate

There total 4 articles about Fluvalinate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 92.1%

(R)-2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoic acid (114298-69-0,74971-63-4,76769-07-8) + methanesulfonyl chloride (124-63-0) + 3-Phenoxybenzaldehyde (39515-51-0) → (RS)-α-cyano-3-phenoxybenzyl (R)-2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoate (102851-06-9,69409-94-5)

Guidance literature:

With dmap; aqueous KOH; In 1-methyl-pyrrolidin-2-one; hexane; water; toluene;

Reference yield: 90.48%

→ picoline (108-89-4) + (RS)-α-cyano-3-phenoxybenzyl (R)-2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoate (102851-06-9,69409-94-5)

Guidance literature:

Reference yield:

→ (RS)-α-cyano-3-phenoxybenzyl (R)-2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoate (102851-06-9,69409-94-5)

Guidance literature:

upstream raw materials:

(R)-2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutanoic acid

methanesulfonyl chloride

3-Phenoxybenzaldehyde

Refernces

• 1、 -. "Macrocyclic plant acaricides". . . Retrieved 2008/06/13.
• 2、 -. "Preparation of alpha-cyanobenzyl esters". . . Retrieved 2008/06/13.