CAS Num: 000629-78-7
SMILES : C(CCCCCCCCCCCCCCC)C
CHEM   : Heptadecane
MOL FOR: C17 H36 
MOL WT : 240.48
------------------------------ EPI SUMMARY (v4.00) --------------------------
 Physical Property Inputs:
    Water Solubility (mg/L):   ------
    Vapor Pressure (mm Hg) :   ------
    Henry LC (atm-m3/mole) :   ------
    Log Kow (octanol-water):   ------
    Boiling Point (deg C)  :   ------
    Melting Point (deg C)  :   ------

 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.67 estimate) =  8.69

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  292.66  (Adapted Stein & Brown method)
    Melting Pt (deg C):  20.45  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00324  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.432  (Modified Grain method)
    MP  (exp database):  22 deg C
    BP  (exp database):  302.0 deg C
    VP  (exp database):  2.28E-04 mm Hg (3.04E-002 Pa) at 25 deg C

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  0.0002938
       log Kow used: 8.69 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  2.6988e-005 mg/L

 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Neutral Organics

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   3.85E+001  atm-m3/mole  (3.91E+006 Pa-m3/mole)
   Group Method:   7.56E+001  atm-m3/mole  (7.66E+006 Pa-m3/mole)
 For Henry LC Comparison Purposes:
   User-Entered Henry LC:  not entered
   Henrys LC [via VP/WSol estimate using User-Entered or Estimated values]:
      HLC:  3.489E+000 atm-m3/mole  (3.536E+005 Pa-m3/mole)
      VP:   0.00324 mm Hg (source: MPBPVP)
      WS:   0.000294 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  8.69  (KowWin est)
  Log Kaw used:  3.197  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  5.493
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.8499
   Biowin2 (Non-Linear Model)     :   0.9638
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.2644  (days-weeks  )
   Biowin4 (Primary Survey Model) :   4.0389  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.7388
   Biowin6 (MITI Non-Linear Model):   0.8874
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.4313
 Ready Biodegradability Prediction:   YES

 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   1.4025
     BioHC Half-Life (days)     :  25.2617

 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  0.0304 Pa (0.000228 mm Hg)
  Log Koa (Koawin est  ): 5.493
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  9.87E-005 
       Octanol/air (Koa) model:  7.64E-008 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.00355 
       Mackay model           :  0.00783 
       Octanol/air (Koa) model:  6.11E-006 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  21.0018 E-12 cm3/molecule-sec
      Half-Life =     0.509 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     6.111 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.00569 (Junge-Pankow, Mackay avg)
      6.11E-006 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  9.686E+004  L/kg (MCI method)
      Log Koc:  4.986       (MCI method)
      Koc    :  3.481E+007  L/kg (Kow method)
      Log Koc:  7.542       (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 v3.00):
   Log BCF from regression-based method = 2.699 (BCF = 500.4 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 1.4384 days (HL = 27.44 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.011 (BCF = 102.5)
   Log BAF Arnot-Gobas method (upper trophic) = 4.805 (BAF = 6.38e+004)
       log Kow used: 8.69 (estimated)

 Volatilization from Water:
    Henry LC:  38.5 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      1.582  hours
    Half-Life from Model Lake :      147.3  hours   (6.137 days)

 Removal In Wastewater Treatment (recommended maximum 95%):
    Total removal:              97.57  percent
    Total biodegradation:        0.42  percent
    Total sludge adsorption:    73.46  percent
    Total to Air:               23.70  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       10.4            12.2         1000       
   Water     78.4            208          1000       
   Soil      5.72            416          1000       
   Sediment  5.44            1.87e+003    0          
     Persistence Time: 95.4 hr