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3-Pyridinecarboximidamide, 6-(trifluoromethyl)-

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  • Name 3-Pyridinecarboximidamide, 6-(trifluoromethyl)-
  • EINECSN/A
  • CAS No. 438249-89-9
  • Density1.46 3
  • PSA62.76000
  • LogP2.18450
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC7H6F3N3
  • Boiling Point225.4 °C at 760 mmHg
  • Molecular Weight189.14
  • Flash Point90.1 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 438249-89-9 (3-Pyridinecarboximidamide,6-(trifluoromethyl)-)
  • Hazard SymbolsN/A
  • SynonymsN/A

3-Pyridinecarboximidamide, 6-(trifluoromethyl)- Specification

This chemical is called 3-Pyridinecarboximidamide, 6-(trifluoromethyl)-, and its systematic name is 6-(trifluoromethyl)pyridine-3-carboximidamide. With the molecular formula of C7H6F3N3, its molecular weight is 189.14. The CAS registry number of this chemical is 438249-89-9. Additionally, its product category is Amidine.

Other characteristics of the 3-Pyridinecarboximidamide, 6-(trifluoromethyl)- can be summarised as followings: (1)ACD/LogP: 0.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.85; (4)ACD/LogD (pH 7.4): -1.25; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.18; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 28.49 Å2; (13)Index of Refraction: 1.52; (14)Molar Refractivity: 39.28 cm3; (15)Molar Volume: 129 cm3; (16)Polarizability: 15.57×10-24cm3; (17)Surface Tension: 37.4 dyne/cm; (18)Density: 1.46 g/cm3; (19)Flash Point: 90.1 °C; (20)Enthalpy of Vaporization: 46.19 kJ/mol; (21)Boiling Point: 225.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0867 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: FC(F)(F)c1ncc(C(=[N@H])N)cc1
2.InChI: InChI=1/C7H6F3N3/c8-7(9,10)5-2-1-4(3-13-5)6(11)12/h1-3H,(H3,11,12)
3.InChIKey: HEJHFZBJXIMGQF-UHFFFAOYAO

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