CAS Num: 000629-62-9
SMILES : C(CCCCCCCCCCCCC)C
CHEM   : Pentadecane
MOL FOR: C15 H32 
MOL WT : 212.42
------------------------------ 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) =  7.71

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  260.59  (Adapted Stein & Brown method)
    Melting Pt (deg C):  12.07  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.0153  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  2.03  (Mean VP of Antoine & Grain methods)
    MP  (exp database):  9.9 deg C
    BP  (exp database):  270.6 deg C
    VP  (exp database):  3.43E-03 mm Hg (4.57E-001 Pa) at 25 deg C

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  0.002866
       log Kow used: 7.71 (estimated)
       no-melting pt equation used
     Water Sol (Exper. database match) =  7.6e-005 mg/L (25 deg C)
        Exper. Ref:  COATES,M ET AL. (1985)

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.00028271 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   2.19E+001  atm-m3/mole  (2.22E+006 Pa-m3/mole)
   Group Method:   3.79E+001  atm-m3/mole  (3.84E+006 Pa-m3/mole)
   Exper Database: 1.26E+01  atm-m3/mole  (1.28E+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:  1.492E+000 atm-m3/mole  (1.512E+005 Pa-m3/mole)
      VP:   0.0153 mm Hg (source: MPBPVP)
      WS:   0.00287 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  7.71  (KowWin est)
  Log Kaw used:  2.712  (exp database)
      Log Koa (KOAWIN v1.10 estimate):  4.998
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.8633
   Biowin2 (Non-Linear Model)     :   0.9754
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.3264  (days-weeks  )
   Biowin4 (Primary Survey Model) :   4.0794  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.7234
   Biowin6 (MITI Non-Linear Model):   0.8824
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.3794
 Ready Biodegradability Prediction:   YES

 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   1.2697
     BioHC Half-Life (days)     :  18.6063

 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  0.457 Pa (0.00343 mm Hg)
  Log Koa (Koawin est  ): 4.998
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  6.56E-006 
       Octanol/air (Koa) model:  2.44E-008 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000237 
       Mackay model           :  0.000525 
       Octanol/air (Koa) model:  1.95E-006 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  18.1757 E-12 cm3/molecule-sec
      Half-Life =     0.588 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     7.062 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.000381 (Junge-Pankow, Mackay avg)
      1.95E-006 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  2.916E+004  L/kg (MCI method)
      Log Koc:  4.465       (MCI method)
      Koc    :  4.91E+006  L/kg (Kow method)
      Log Koc:  6.691       (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 = 3.181 (BCF = 1516 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 1.1601 days (HL = 14.46 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.671 (BCF = 469.1)
   Log BAF Arnot-Gobas method (upper trophic) = 4.861 (BAF = 7.266e+004)
       log Kow used: 7.71 (estimated)

 Volatilization from Water:
    Henry LC:  12.6 atm-m3/mole  (Henry experimental database)
    Half-Life from Model River:      1.487  hours
    Half-Life from Model Lake :      138.4  hours   (5.768 days)

 Removal In Wastewater Treatment (recommended maximum 95%):
    Total removal:              98.92  percent
    Total biodegradation:        0.28  percent
    Total sludge adsorption:    65.87  percent
    Total to Air:               32.77  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       11.1            11.6         1000       
   Water     72.4            208          1000       
   Soil      5.61            416          1000       
   Sediment  10.9            1.87e+003    0          
     Persistence Time: 90.6 hr