CAS Number: 19430-93-4
SMILES : FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C=C
CHEM   : 1-Hexene, 3,3,4,4,5,5,6,6,6-nonafluoro-
MOL FOR: C6 H3 F9 
MOL WT : 246.08
------------------------------ EPI SUMMARY (v4.11) --------------------------
 Physical Property Inputs:
    Log Kow (octanol-water):   ------
    Boiling Point (deg C)  :   ------
    Melting Point (deg C)  :   ------
    Vapor Pressure (mm Hg) :   ------
    Water Solubility (mg/L):   ------
    Henry LC (atm-m3/mole) :   ------
 
 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.68 estimate) =  4.40
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  7.79  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -105.83  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  1.38E+003  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  1.83E+005  (Mean VP of Antoine & Grain methods)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  4.36
       log Kow used: 4.40 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.14732 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.11E+002  atm-m3/mole  (1.12E+007 Pa-m3/mole)
   Group Method:   Incomplete
 For Henry LC Comparison Purposes:
   User-Entered Henry LC:  not entered
   Henrys LC [via VP/WSol estimate using User-Entered or Estimated values]:
      HLC:  5.644E+001 atm-m3/mole  (5.719E+006 Pa-m3/mole)
      VP:   1.38E+003 mm Hg (source: MPBPVP)
      WS:   4.36 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  4.40  (KowWin est)
  Log Kaw used:  3.657  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  0.743
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :  -0.4418
   Biowin2 (Non-Linear Model)     :   0.0000
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   1.5061  (recalcitrant)
   Biowin4 (Primary Survey Model) :   2.7580  (weeks       )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.3579
   Biowin6 (MITI Non-Linear Model):   0.0000
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.3872
 Ready Biodegradability Prediction:   NO
 
Hydrocarbon Biodegradation (BioHCwin v1.01):
    Structure incompatible with current estimation method!
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  1.83E+005 Pa (1.37E+003 mm Hg)
  Log Koa (Koawin est  ): 0.743
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.64E-011 
       Octanol/air (Koa) model:  1.36E-012 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  5.93E-010 
       Mackay model           :  1.31E-009 
       Octanol/air (Koa) model:  1.09E-010 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  19.9880 E-12 cm3/molecule-sec
      Half-Life =     0.535 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     6.421 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     0.175000 E-17 cm3/molecule-sec
      Half-Life =     6.549 Days (at 7E11 mol/cm3)
   Fraction sorbed to airborne particulates (phi):
      9.54E-010 (Junge-Pankow, Mackay avg)
      1.09E-010 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  7754  L/kg (MCI method)
      Log Koc:  3.890       (MCI method)
      Koc    :  6582  L/kg (Kow method)
      Log Koc:  3.818       (Kow method)
 
 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
    Rate constants can NOT be estimated for this structure!
 
 Bioaccumulation Estimates (BCFBAF v3.01):
   Log BCF from regression-based method = 2.569 (BCF = 370.7 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.8796 days (HL = 7.579 days)
   Log BCF Arnot-Gobas method (upper trophic) = 3.144 (BCF = 1394)
   Log BAF Arnot-Gobas method (upper trophic) = 3.170 (BAF = 1478)
       log Kow used: 4.40 (estimated)
 
 Volatilization from Water:
    Henry LC:  111 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      1.601  hours
    Half-Life from Model Lake :        149  hours   (6.208 days)
 
 Removal In Wastewater Treatment (recommended maximum 95%):
    Total removal:             100.00  percent
    Total biodegradation:        0.10  percent
    Total sludge adsorption:    29.97  percent
    Total to Air:               69.94  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       7.06            11.9         1000       
   Water     49.3            4.32e+003    1000       
   Soil      0.437           8.64e+003    1000       
   Sediment  43.2            3.89e+004    0          
     Persistence Time: 185 hr