2,3,5,6-Tetrafluoro-4-Aminobenzotrifluoride
[CAS# 651-83-2]

Identification

• Classification: Organic raw materials >> Organic fluorine compound >> Fluorotoluene series
• Name: 2,3,5,6-Tetrafluoro-4-Aminobenzotrifluoride
• Synonyms: [2,3,5,6-Tetrafluoro-4-(Trifluoromethyl)Phenyl]Amine; 2,3,5,6,Alpha,Alpha,Alpha-Heptafluoro-P-Toluidine; 87283_Fluka
• Molecular Formula: C₇H₂F₇N
• Molecular Weight: 233.09
• CAS Registry Number: 651-83-2
• SMILES: C1(=C(C(=C(C(=C1F)F)N)F)F)C(F)(F)F
• InChI: 1S/C7H2F7N/c8-2-1(7(12,13)14)3(9)5(11)6(15)4(2)10/h15H2
• InChIKey: FJOACTZFMHZHSC-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 171.7±40.0°C at 760 mmHg (Cal.)
• Flash point: 67.9±18.0°C (Cal.)
• Refractive index: 1.431 (Expl.)

Safety Data

• Safety Code: S26;S36/37
• Risk Code: R20/21/22;R36/37/38
• Hazard Symbol: X
• Transport Information: UN2810
• Safety Description: DANGER: POISON, irritates skin, eyes, lungs

References

• (1): Wen-Guang Wang, Hong-Yan Wang, Gang Si, Chen-Ho Tung and Li-Zhu Wu. Fluorophenyl-substituted Fe-only hydrogenases active site ADT models: different electrocatalytic process for protonreduction in HOAc and HBF/Et2O, Dalton Trans., 2009, 2712.