Product Name

  • Name

    3,3,4,5,5,5-HEXAFLUOROPENTAN-2-ONE

  • EINECS
  • CAS No. 60249-67-4
  • Article Data1
  • CAS DataBase
  • Density 1.373 g/cm3
  • Solubility
  • Melting Point
  • Formula C5H4F6O
  • Boiling Point 77.4 °C at 760 mmHg
  • Molecular Weight 194.077
  • Flash Point 17.9 °C
  • Transport Information
  • Appearance
  • Safety 26-36/37/39
  • Risk Codes 36/27/38
  • Molecular Structure Molecular Structure of 60249-67-4 (3,3,4,5,5,5-HEXAFLUOROPENTAN-2-ONE)
  • Hazard Symbols IrritantXi
  • Synonyms 1,1,2,3,3,3-Hexafluoropropylmethyl ketone;
  • PSA 17.07000
  • LogP 2.11110

2-Pentanone,3,3,4,5,5,5-hexafluoro- Specification

This chemical is called 2-Pentanone,3,3,4,5,5,5-hexafluoro-, and its CAS registry number is 60249-67-4. With the molecular formula of C5H4F6O, its molecular weight is 194.07.

Other characteristics of the 2-Pentanone,3,3,4,5,5,5-hexafluoro- can be summarised as followings: (1)ACD/LogP: 2.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.09; (4)ACD/LogD (pH 7.4): 2.09; (5)ACD/BCF (pH 5.5): 22.69; (6)ACD/BCF (pH 7.4): 22.69; (7)ACD/KOC (pH 5.5): 325.18; (8)ACD/KOC (pH 7.4): 325.18; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.296; (14)Molar Refractivity: 26.11 cm3; (15)Molar Volume: 141.3 cm3; (16)Polarizability: 10.35×10-24cm3; (17)Surface Tension: 15.5 dyne/cm; (18)Density: 1.373 g/cm3; (19)Flash Point: 17.9 °C; (20)Enthalpy of Vaporization: 31.84 kJ/mol; (21)Boiling Point: 77.4 °C at 760 mmHg; (22)Vapour Pressure: 97 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: FC(C(F)(F)F)C(F)(F)C(=O)C
2.InChI: InChI=1/C5H4F6O/c1-2(12)4(7,8)3(6)5(9,10)11/h3H,1H3
3.InChIKey: XHYIGFFINCTUHK-UHFFFAOYAY

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