ChemicalBook--->CAS DataBase List--->328-74-5

328-74-5

328-74-5 Structure

328-74-5 Structure
IdentificationMore
[Name]

3,5-Di(trifluoromethyl)aniline
[CAS]

328-74-5
[Synonyms]

3,5-BIS(TRIFLUOROMETHYL)ANILINE
3,5-DI(TRIFLUOROMETHYL)ANILINE
5-AMINO-ALPHA,ALPHA,ALPHA,ALPHA',ALPHA',ALPHA'-HEXAFLUORO-M-XYLENE
A,A,A,A',A',A'-HEXAFLUORO-3,5-XYLIDINE
AKOS BBS-00003710
ALPHA,ALPHA,ALPHA,ALPHA',ALPHA',ALPHA'-HEXAFLUORO-3,5-XYLIDINE
MBT-NH2
TIMTEC-BB SBB000690
,,,’,’,’-Hexafluoro-3,5-xylidine
,5-Bis-trifluoromethyl-phenylamine
,5-Xylidine, a,a,a,a',a',a'-hexafluoro-
,a,a,a',a',a'-Hexafluoro-3,5-xylidine
3,5-bis(trifluoromethyl)-anilin
3,5-bis(trifluoromethyl)-benzenamin
3,5-Bis(trifluoromethyl)benzenamine
3,5-Xylidine, alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-
3,5-Xylidine, alpha,alpha,alpha,alpha,alpha,alpha-hexafluro-
alpha,alpha,alpha,alpha’,alpha’,alpha’-hexafluoro-5-xylidine
Aniline, 3,5-bis(trifluoromethyl)-
3,5-BIS(TRIFLUOROMETHYL)AMILINE
[EINECS(EC#)]

206-335-0
[Molecular Formula]

C8H5F6N
[MDL Number]

MFCD00000394
[Molecular Weight]

229.12
[MOL File]

328-74-5.mol
Chemical PropertiesBack Directory
[Appearance]

clear light yellow to yellow-brown liquid
[Melting point ]

168.2-169.2 °C
[Boiling point ]

85 °C15 mm Hg(lit.)
[density ]

1.467 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.434(lit.)
[Fp ]

182 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

Liquid
[pka]

2.15±0.10(Predicted)
[color ]

Clear light yellow to yellow-brown
[Specific Gravity]

1.473
[Water Solubility ]

Not miscible in water.
[BRN ]

654318
[InChI]

1S/C8H5F6N/c9-7(10,11)4-1-5(8(12,13)14)3-6(15)2-4/h1-3H,15H2
[InChIKey]

CDIDGWDGQGVCIB-UHFFFAOYSA-N
[SMILES]

Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
[CAS DataBase Reference]

328-74-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzenamine, 3,5-bis(trifluoromethyl)-(328-74-5)
[EPA Substance Registry System]

328-74-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R33:Danger of cumulative effects.
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S36:Wear suitable protective clothing .
[RIDADR ]

2810
[WGK Germany ]

3
[RTECS ]

ZE9800000
[Hazard Note ]

Irritant
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29214910
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Toluene-->Nitric acid
[Preparation Products]

5,7-Bis(trifluoromethyl)-4-chloroquinoline-->5,7-Bis(trifluoromethyl)-4-hydroxyquinoline-->IMD-0354-->5,7-Bis(trifluoromethyl)-4-hydroxyquinoline-3-carboxylic acid-->4-Hydroxy-5,7-bis-trifluoromethyl-quinoline-3-carboxylic acid ethyl ester-->3,5-Bis(trifluoromethyl)phenol-->3,5-bis(trifluoromethyl)benzenediazonium-->3,5-Bis(trifluoromethyl)-N-(bromoacetyl)aniline-->tert-butyl 3,5-bis(trifluoromethyl)phenylcarbamate-->2-(2-[3,5-Bis(trifluoromethyl)phenyl]hydrazono)malononitrile-->1-[3,5-Bis(trifluoromethyl)phenyl]-3-[4-(trifluoromethyl)phenyl]urea, 97%-->N1-methyl-3,5-di(trifluoromethyl)aniline
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,5-Di(trifluoromethyl)aniline(328-74-5).msds
Hazard InformationBack Directory
[Chemical Properties]

clear light yellow to yellow-brown liquid
[Uses]

3,5-Bis(trifluoromethyl)aniline was used in the synthesis of N-[2-hydroxy-1-naphthylidene]-3, 5-bis(trifluoromethyl)aniline, Schiff?s base and 5,7-bis(trifluoromethyl)aniline. It was also used in the synthesis of N-1-phenylethyl-3,5-bis(trifluoromethyl)aniline via titanium-catalyzed hydroamination reaction and N,N?-bis[3,5-bis(tri-fluoromethyl)phenyl]thiourea, organocatalyst.
[Synthesis]

The synthesis of 3,5-Bis(trifluoromethyl)aniline is as follows is as follows:Put 259g (1mol) 3,5-Bis(trifluoromethyl)nitrobenzeneand 500g ethyl acetate into a 1L autoclave, add 5g palladium-carbon as a catalyst, raise the temperature to 60℃, then pass the hydrogen pressure to 2MPa, keep the temperature and react for 20 hours, then cooling, filtration, concentration, and distillation to obtain 3,5-Bis(trifluoromethyl)aniline with a purity of 98.5% and a yield of 87%.
328-74-5.png
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Bis(trifluoromethyl)aniline(328-74-5)MS
3,5-Bis(trifluoromethyl)aniline(328-74-5)1HNMR
3,5-Bis(trifluoromethyl)aniline(328-74-5)19FNMR
3,5-Bis(trifluoromethyl)aniline(328-74-5)IR1
3,5-Bis(trifluoromethyl)aniline(328-74-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,5-Bis(trifluoromethyl)aniline, 98+%(328-74-5)
[Alfa Aesar]

3,5-Bis(trifluoromethyl)aniline, 98%(328-74-5)
[Sigma Aldrich]

328-74-5(sigmaaldrich)
[TCI AMERICA]

3,5-Bis(trifluoromethyl)aniline,>97.0%(GC)(328-74-5)
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