Product Name

  • Name

    N-[4-Amino-3-(trifluoromethyl)phenyl]-2-methylpropanamide (FLU-6)

  • EINECS
  • CAS No. 39235-51-3
  • Article Data20
  • CAS DataBase
  • Density 1.284 g/cm3
  • Solubility
  • Melting Point
  • Formula C11H13F3N2O
  • Boiling Point 289.154 °C at 760 mmHg
  • Molecular Weight 246.232
  • Flash Point 128.676 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 39235-51-3 (N-[4-Amino-3-(trifluoromethyl)phenyl]-2-methylpropanamide (FLU-6))
  • Hazard Symbols
  • Synonyms N-[4-amino-3-(trifluoromethyl)phenyl]-2-methylpropanamide;
  • PSA 58.61000
  • LogP 4.11280

N-[4-Amino-3-(trifluoromethyl)phenyl]-2-methylpropanamide (FLU-6) Specification

The Propanamide, N-[4-amino-3-(trifluoromethyl)phenyl]-2-methyl-, with its CAS registry number 39235-51-3, has its systematic name of N-[4-amino-3-(trifluoromethyl)phenyl]-2-methylpropanamide. And this chemical has its molecular formula of C11H13F3N2O. Besides, it should be kept in the cool and dry place.

Physical properties of Propanamide, N-[4-amino-3-(trifluoromethyl)phenyl]-2-methyl-: (1)ACD/LogP: 2.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 108; (6)ACD/BCF (pH 7.4): 108; (7)ACD/KOC (pH 5.5): 994; (8)ACD/KOC (pH 7.4): 994; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 55.12 Å2; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 58.965 cm3; (15)Molar Volume: 191.697 cm3; (16)Polarizability: 23.376×10-24cm3; (17)Surface Tension: 36.446 dyne/cm; (18)Density: 1.284 g/cm3; (19)Flash Point: 128.676 °C; (20)Enthalpy of Vaporization: 52.844 kJ/mol; (21)Boiling Point: 289.154 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:FC(F)(F)c1cc(ccc1N)NC(=O)C(C)C
(2)Std. InChI:InChI=1S/C11H13F3N2O/c1-6(2)10(17)16-7-3-4-9(15)8(5-7)11(12,13)14/h3-6H,15H2,1-2H3,(H,16,17)
(3)Std. InChIKey:SAKLWQRDMOSOGQ-UHFFFAOYSA-N

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