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454-79-5

454-79-5 Structure

454-79-5 Structure
IdentificationMore
[Name]

2-Bromo-5-(trifluoromethyl)aniline
[CAS]

454-79-5
[Synonyms]

2-AMINO-1-BROMO-4-TRIFLUOROMETHYLBENZENE
2-BROMO-5-(TRIFLUOROMETHYL)ANILINE
3-AMINO-4-BROMOBENZOTRIFLUORIDE
3-AMINO-4-BROMO(TRIFLUOROMETHYL)BENZENE
4-BROMO-3-AMINOBENZOTRIFLUORIDE
6-Bromo-alpha,alpha,alpha-trifluoro-m-toluidine
Benzenamine, 2-bromo-5-(trifluoromethyl)-
3-Amino-4-bromobenzotrifluoride (2-Bromo-5-trifluoromethylaniline)
2-AMINO-4-TRIFLUOROMETHYLBROMOBENZENE
3-Amino-4-bromobenzotrifluoride 98%
3-Amino-4-bromobenzotrifluoride98%
2-BROMO-5-(TRIFLUOROMETHYL)ANILIME
2-BROMO-5-(TRIFLUOROMETHYL)ANILINE/3-AMINO-4-BROMOBENZOTRIFLUORIDE/
2-amino-4-trifluoromthylbromobenzene
2-Bromo-5-trifluoromethylphenylamine
5-(Trifluoromethyl)-2-bromoaniline
[EINECS(EC#)]

207-227-6
[Molecular Formula]

C7H5BrF3N
[MDL Number]

MFCD00007637
[Molecular Weight]

240.02
[MOL File]

454-79-5.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to light yellow liquid
[Melting point ]

47-49°C
[Boiling point ]

81-82 °C
[density ]

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

n20/D 1.522(lit.)
[Fp ]

>230 °F
[storage temp. ]

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

clear liquid
[pka]

1.31±0.10(Predicted)
[color ]

Colorless to Light yellow to Light orange
[Specific Gravity]

1.675
[Water Solubility ]

Not miscible or difficult to mix in water.
[BRN ]

2094535
[InChI]

1S/C7H5BrF3N/c8-5-2-1-4(3-6(5)12)7(9,10)11/h1-3H,12H2
[InChIKey]

PZDVFXUBTKPFSG-UHFFFAOYSA-N
[SMILES]

Nc1cc(ccc1Br)C(F)(F)F
[CAS DataBase Reference]

454-79-5(CAS DataBase Reference)
[NIST Chemistry Reference]

6-Bromo-alpha,alpha,alpha-trifluoro-m-toluidine(454-79-5)
Safety DataBack Directory
[Hazard Codes ]

C,Xi
[Risk Statements ]

R34:Causes burns.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 3267 8/PG 2
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29214300
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1B
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Amino-4-bromobenzotrifluoride(454-79-5).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to light yellow liquid
[Uses]

2-Bromo-5-(trifluoromethyl)aniline is used in the synthesis and biochemical evaluation of series of inhibitors of hepatitis C virus (HCV) NS3 protease.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Bromo-5-(trifluoromethyl)aniline(454-79-5)1HNMR
2-Bromo-5-(trifluoromethyl)aniline(454-79-5)IR
2-Bromo-5-(trifluoromethyl)aniline(454-79-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Bromo-5-(trifluoromethyl)aniline, 98%(454-79-5)
[Alfa Aesar]

2-Bromo-5-(trifluoromethyl)aniline, 97%(454-79-5)
[Sigma Aldrich]

454-79-5(sigmaaldrich)
[TCI AMERICA]

3-Amino-4-bromobenzotrifluoride,>97.0%(GC)(454-79-5)
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