CAS No.96525-23-4,FLURTAMONE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	96525-23-4
Name:	FLURTAMONE
Article Data:	3

Formula:	C18H14 F3 N O2
Molecular Weight:	333.31
Synonyms:	3(2H)-Furanone,5-(methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]-, (?à)-; Bacara; Benchmark;Fluortanone; Flurtamone; RE 40885
Density:	1.33 g/cm³
Melting Point:	152.5℃
Boiling Point:	446.2 °C at 760 mmHg
Flash Point:	223.6 °C
Hazard Symbols:
Risk Codes:	50/53
Safety:	Moderately toxic by ingestion and skin contact routes. Questionable carcinogen with neoplastigenic data reported. When heated to decomposition it emits toxic vapors of NO_x and F⁻.
PSA:	38.33000
LogP:	4.32490

Synthetic route

: 96525-22-3
2-phenyl-3-oxo-4-(3-trifluoromethylphenyl)-5-amino-2,3-dihydrofuran

: 56-37-1
N-benzyl-N,N,N-triethylammonium chloride

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
With sodium hydroxide; dimethyl sulfate In dichloromethane; water

: 96525-22-3
2-phenyl-3-oxo-4-(3-trifluoromethylphenyl)-5-amino-2,3-dihydrofuran

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
With methylamine In tetrahydrofuran; methanol; water
With hydrogenchloride In methanol; water; methylamine

: 96525-22-3
2-phenyl-3-oxo-4-(3-trifluoromethylphenyl)-5-amino-2,3-dihydrofuran

: 77-78-1
dimethyl sulfate

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
With trimethyldodecylammonium chloride; sodium sulfite In water; 1,2-dichloro-ethane at 20℃; for 2.5h; Reagent/catalyst; Large scale;

: 2338-76-3
3-trifluoromethylphenylacetonitrile

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: sodium methylate / methanol / 16 h / 25 °C / Large scale 2: bromine / methanol / 13 h / 20 °C / Large scale 3: N-benzyl-N,N,N-triethylammonium chloride; sodium hydroxide / 1,2-dichloro-ethane; water / 3.5 h / 20 °C / Large scale View Scheme
Multi-step reaction with 3 steps 1: sodium methylate / methanol / 16 h / 25 °C / Large scale 2: bromine / methanol / 13 h / 20 °C / Large scale 3: sodium sulfite; trimethyldodecylammonium chloride / 1,2-dichloro-ethane; water / 2.5 h / 20 °C / Large scale View Scheme

: 101-97-3
Ethyl 2-phenylethanoate

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: sodium methylate / methanol / 16 h / 25 °C / Large scale 2: bromine / methanol / 13 h / 20 °C / Large scale 3: N-benzyl-N,N,N-triethylammonium chloride; sodium hydroxide / 1,2-dichloro-ethane; water / 3.5 h / 20 °C / Large scale View Scheme
Multi-step reaction with 3 steps 1: sodium methylate / methanol / 16 h / 25 °C / Large scale 2: bromine / methanol / 13 h / 20 °C / Large scale 3: sodium sulfite; trimethyldodecylammonium chloride / 1,2-dichloro-ethane; water / 2.5 h / 20 °C / Large scale View Scheme

: 68084-26-4
(3-trifluoromethylphenyl)benzylcarbonylacetonitrile

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: bromine / methanol / 13 h / 20 °C / Large scale 2: N-benzyl-N,N,N-triethylammonium chloride; sodium hydroxide / 1,2-dichloro-ethane; water / 3.5 h / 20 °C / Large scale View Scheme

: 96525-22-3
2-phenyl-3-oxo-4-(3-trifluoromethylphenyl)-5-amino-2,3-dihydrofuran

: 616-38-6
carbonic acid dimethyl ester

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
With N-benzyl-N,N,N-triethylammonium chloride; sodium hydroxide In water; 1,2-dichloro-ethane at 20℃; for 3.5h; Reagent/catalyst; Large scale;

: 96525-23-4
2-Phenyl-3-oxo-4-(-3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

: Lithium salt of 2-phenyl-3-oxo-4-(3-trifluoromethylphenyl)-5-methylamino-2,3-dihydrofuran

Conditions

Conditions	Yield
With n-butyllithium In tetrahydrofuran; hexane

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Chemistry

IUPAC Name: 5-(Methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]furan-3-one
Synonyms: 3(2H)-Furanone, 5-(methylamino)-2-phenyl-4-[3-(trifluoromethyl)phenyl]- ; 5-(Methylamino)-2-phenyl-4-[3-(trifluormethyl)phenyl]-3(2H)-furanon ; 5-(Methylamino)-2-phenyl-4-[3-(trifluormethyl)phenyl]furan-3(2H)-on
Product Categories: Alpha sort;E-GAlphabetic;F;FA - FLPesticides&Metabolites;Herbicides;Others;Pesticides&Metabolites CAS NO:96525-23-4
Molecular Formula of (+-)-5-(Methylamino)-2-phenyl-4-(3-(trifluoromethyl)phenyl)-3(2h)-furanone (CAS NO:96525-23-4) : C₁₈H₁₄F₃NO₂
Molecular Weight of (+-)-5-(Methylamino)-2-phenyl-4-(3-(trifluoromethyl)phenyl)-3(2h)-furanone (CAS NO:96525-23-4) :333.3045
Molecular Structure of (+-)-5-(Methylamino)-2-phenyl-4-(3-(trifluoromethyl)phenyl)-3(2h)-furanone (CAS NO:96525-23-4) :
Index of Refraction: 1.576
Surface Tension: 44 dyne/cm
Density: 1.33 g/cm³
Flash Point: 223.6 °C
Enthalpy of Vaporization: 70.43 kJ/mol
Boiling Point: 446.2 °C at 760 mmHg
Vapour Pressure: 3.73E-08 mmHg at 25°C

Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rat	LD50	oral	> 500mg/kg (500mg/kg)		Farm Chemicals Handbook. Vol. -, Pg. C40, 1991.
rat	LD50	skin	> 500mg/kg (500mg/kg)		Farm Chemicals Handbook. Vol. -, Pg. C40, 1991.

Safety Profile

Moderately toxic by ingestion and skin contact routes. Questionable carcinogen with neoplastigenic data reported. When heated to decomposition it emits toxic vapors of NO_x and F⁻.
Hazard Codes Dangerous N
Risk Statements 50/53
R50/53:Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements 60-61
S60:This material and its container must be disposed of as hazardous waste.
S61:Avoid release to the environment. Refer to special instructions / safety data sheets.
RIDADR UN3077 9/PG 3
RTECS LU5105000