Product Name

  • Name

    2-(2,2,2-TRIFLUOROETHOXY)ANILINE

  • EINECS
  • CAS No. 57946-60-8
  • Article Data7
  • CAS DataBase
  • Density 1.286 g/cm3
  • Solubility
  • Melting Point 49.0 to 53.0 °C
  • Formula C8H8F3NO
  • Boiling Point 214.9 °C at 760 mmHg
  • Molecular Weight 191.153
  • Flash Point 83.8 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 57946-60-8 (2-(2,2,2-TRIFLUOROETHOXY)ANILINE)
  • Hazard Symbols
  • Synonyms 2-(2,2,2-Trifluoroethoxy)aniline;2-(2,2,2-Trifluoroethoxy)benzenamine;
  • PSA 35.25000
  • LogP 2.79110

Benzenamine,2-(2,2,2-trifluoroethoxy)- Specification

The CAS register number of Benzenamine,2-(2,2,2-trifluoroethoxy)- is 57946-60-8. It also can be called as 2-(2,2,2-Trifluoroethoxy)benzenamine and the systematic name about this chemical is 2-(2,2,2-trifluoroethoxy)aniline. The molecular formula about this chemical is C8H8F3NO and the molecular weight is 191.1504.

Physical properties about Benzenamine,2-(2,2,2-trifluoroethoxy)- are: (1)ACD/LogP: 2.06; (2)ACD/LogD (pH 5.5): 2.05; (3)ACD/LogD (pH 7.4): 2.06; (4)ACD/BCF (pH 5.5): 21.11; (5)ACD/BCF (pH 7.4): 21.51; (6)ACD/KOC (pH 5.5): 307.15; (7)ACD/KOC (pH 7.4): 312.94; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 12.47Å2; (12)Index of Refraction: 1.48; (13)Molar Refractivity: 42.25 cm3; (14)Molar Volume: 148.6 cm3; (15)Polarizability: 16.75x10-24cm3; (16)Surface Tension: 31.8 dyne/cm; (17)Enthalpy of Vaporization: 45.12 kJ/mol; (18)Boiling Point: 214.9 °C at 760 mmHg; (19)Vapour Pressure: 0.152 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)COc1ccccc1N
(2)InChI: InChI=1/C8H8F3NO/c9-8(10,11)5-13-7-4-2-1-3-6(7)12/h1-4H,5,12H2
(3)InChIKey: JIKIVGTUYSNUPQ-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C8H8F3NO/c9-8(10,11)5-13-7-4-2-1-3-6(7)12/h1-4H,5,12H2
(5)Std. InChIKey: JIKIVGTUYSNUPQ-UHFFFAOYSA-N

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