CAS Num: 000638-68-6
SMILES : C(CCCCCCCCCCCCCCCCCCCCCCCCCCCC)C
CHEM   : Triacontane
MOL FOR: C30 H62 
MOL WT : 422.83
------------------------------ 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) =  15.07

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  450.46  (Adapted Stein & Brown method)
    Melting Pt (deg C):  152.03  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  5.62E-007  (Modified Grain method)
    VP (Pa, 25 deg C) :  7.49E-005  (Modified Grain method)
    MP  (exp database):  65.8 deg C
    BP  (exp database):  449.7 deg C
    VP  (exp database):  2.73E-11 mm Hg (3.64E-009 Pa) at 25 deg C
    Subcooled liquid VP: 6.91E-011 mm Hg (25 deg C, exp database VP )
                       : 9.22E-009 Pa  (25 deg C, exp database VP )

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  8.579e-011
       log Kow used: 15.07 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  4.2283e-007 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.53E+003  atm-m3/mole  (1.55E+008 Pa-m3/mole)
   Group Method:   6.74E+003  atm-m3/mole  (6.83E+008 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:  3.645E+003 atm-m3/mole  (3.693E+008 Pa-m3/mole)
      VP:   5.62E-007 mm Hg (source: MPBPVP)
      WS:   8.58E-011 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  15.07  (KowWin est)
  Log Kaw used:  4.796  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  10.274
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.7631
   Biowin2 (Non-Linear Model)     :   0.6664
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.8615  (weeks       )
   Biowin4 (Primary Survey Model) :   3.7758  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.8387
   Biowin6 (MITI Non-Linear Model):   0.9156
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.7692
 Ready Biodegradability Prediction:   YES

 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   2.1552
     BioHC Half-Life (days)     : 142.9654

 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  9.21E-009 Pa (6.91E-011 mm Hg)
  Log Koa (Koawin est  ): 10.274
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  326 
       Octanol/air (Koa) model:  0.00461 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  1 
       Mackay model           :  1 
       Octanol/air (Koa) model:  0.27 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  39.3714 E-12 cm3/molecule-sec
      Half-Life =     0.272 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     3.260 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      1 (Junge-Pankow, Mackay avg)
      0.27 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  2.369E+008  L/kg (MCI method)
      Log Koc:  8.375       (MCI method)
      Koc    :  1.199E+013  L/kg (Kow method)
      Log Koc:  13.079      (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 = 0.500 (BCF = 3.162 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 3.2474 days (HL = 1767 days)
   Log BCF Arnot-Gobas method (upper trophic) = -0.049 (BCF = 0.8936)
   Log BAF Arnot-Gobas method (upper trophic) = 0.565 (BAF = 3.676)
       log Kow used: 15.07 (estimated)

 Volatilization from Water:
    Henry LC:  1.53E+003 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      2.098  hours
    Half-Life from Model Lake :      195.3  hours   (8.138 days)

 Removal In Wastewater Treatment:
    Total removal:              94.04  percent
    Total biodegradation:        0.78  percent
    Total sludge adsorption:    93.26  percent
    Total to Air:                0.00  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       1.52            6.52         1000       
   Water     40.1            360          1000       
   Soil      58.4            720          1000       
   Sediment  0.00477         3.24e+003    0          
     Persistence Time: 285 hr