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193135 Sigma-Aldrich

3,5-Bis(trifluoromethyl)aniline

97%

Synonym: α,α,α,α′,α′,α′-Hexafluoro-3,5-xylidine, 5-Amino-α,α,α,α′,α′,α′-hexafluoro-m-xylene

  • CAS Number 328-74-5

  • Linear Formula (CF3)2C6H3NH2

  • Molecular Weight 229.12

  •  Beilstein/REAXYS Number 654318

  •  EC Number 206-335-0

  •  MDL number MFCD00000394

  •  PubChem Substance ID 24851584

  •  NACRES NA.22

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Properties

Quality Level   100
assay   97%
refractive index   n20/D 1.434 (lit.)
bp   85 °C/15 mmHg (lit.)
density   1.467 g/mL at 25 °C (lit.)
SMILES string   Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
InChI   1S/C8H5F6N/c9-7(10,11)4-1-5(8(12,13)14)3-6(15)2-4/h1-3H,15H2
InChI key   CDIDGWDGQGVCIB-UHFFFAOYSA-N

Description

Application

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

Packaging

10, 50 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
Target organs 
Respiratory system
WGK Germany 
WGK 3
RTECS 
ZE9800000
Flash Point(F) 
208.4 °F - closed cup
Flash Point(C) 
98 °C - closed cup
Protocols & Articles
Peer-Reviewed Papers
15

References

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