CAS Number: 61788-85-0
SMILES : CCCCCCC(CC=CCCCCCCCC(=O)(OCC(COC(=O)(CCCCCCCC=CCC(CCCCCC)O))OC(=O)(CC
         CCCCCC=CCC(CCCCCC)O)))OCCOCCOCCOCCOCCO
CHEM   : Castor oil, hydrogenated, ethoxylated
MOL FOR: C67 H124 O14 
MOL WT : 1153.73
------------------------------ EPI SUMMARY (v4.10) --------------------------
    Henry LC (atm-m3/mole) :   ------
    Log Kow (octanol-water):   ------
    Boiling Point (deg C)  :   ------
    Water Solubility (mg/L):   ------
 Physical Property Inputs:
    Vapor Pressure (mm Hg) :   ------
    Melting Point (deg C)  :   ------
 
 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.68 estimate) =  17.71
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  1107.42  (Adapted Stein & Brown method)
    Melting Pt (deg C):  349.84  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  1.02E-036  (Modified Grain method)
    VP (Pa, 25 deg C) :  1.37E-034  (Modified Grain method)
    Subcooled liquid VP: 5.25E-033 mm Hg (25 deg C, Mod-Grain method)
                       : 7E-031 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  2.16e-017
       log Kow used: 17.71 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  1.1537e-006 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   4.26E-020  atm-m3/mole  (4.31E-015 Pa-m3/mole)
   Group Method:   4.55E-033  atm-m3/mole  (4.62E-028 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:  7.028E+001 atm-m3/mole  (7.121E+006 Pa-m3/mole)
      VP:   1E-015 mm Hg (source: MPBPVP)
      WS:   2.16E-017 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  17.71  (KowWin est)
  Log Kaw used:  -17.759  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  35.469
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :  -0.2145
   Biowin2 (Non-Linear Model)     :   0.0001
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.4018  (weeks-months)
   Biowin4 (Primary Survey Model) :   4.0169  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   1.1577
   Biowin6 (MITI Non-Linear Model):   0.6832
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.5073
 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):  7E-031 Pa (5.25E-033 mm Hg)
  Log Koa (Koawin est  ): 35.469
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  4.29E+024 
       Octanol/air (Koa) model:  7.23E+022 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  1 
       Mackay model           :  1 
       Octanol/air (Koa) model:  1 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 333.5941 E-12 cm3/molecule-sec [Cis-isomer]
      OVERALL OH Rate Constant = 356.3941 E-12 cm3/molecule-sec [Trans-isomer]
      Half-Life =   23.085 Min (12-hr day; 1.5E6 OH/cm3) [Cis-isomer]
      Half-Life =   21.608 Min (12-hr day; 1.5E6 OH/cm3) [Trans-isomer]
   Ozone Reaction:
      OVERALL Ozone Rate Constant =    39.000000 E-17 cm3/molecule-sec [Cis-]
      OVERALL Ozone Rate Constant =    60.000000 E-17 cm3/molecule-sec [Trans-]
      Half-Life =    42.314 Min (at 7E11 mol/cm3) [Cis-isomer]
      Half-Life =    27.504 Min (at 7E11 mol/cm3) [Trans-isomer]
   Reaction With Nitrate Radicals May Be Important!
   Fraction sorbed to airborne particulates (phi):
      1 (Junge-Pankow, Mackay avg)
      1 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  1E+010  L/kg (MCI method)
      Log Koc:  11.732      (MCI method)
      Koc    :  2.06E+009  L/kg (Kow method)
      Log Koc:  9.314       (Kow method)
 
 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  1.455E-001  L/mol-sec
  Kb Half-Life at pH 8:      55.135  days   
  Kb Half-Life at pH 7:       1.510  years  
    (Total Kb applies only to esters, carbmates, alkyl halides)
 
 Bioaccumulation Estimates (BCFBAF v3.01):
   Log BCF from regression-based method = 0.500 (BCF = 3.162 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.3342 days (HL = 2.159 days)
   Log BCF Arnot-Gobas method (upper trophic) = -0.049 (BCF = 0.893)
   Log BAF Arnot-Gobas method (upper trophic) = -0.049 (BAF = 0.893)
       log Kow used: 17.71 (estimated)
 
 Volatilization from Water:
    Henry LC:  4.26E-020 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River: 4.668E+016  hours   (1.945E+015 days)
    Half-Life from Model Lake : 5.093E+017  hours   (2.122E+016 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       0.0162          0.368        1000       
   Water     17.7            900          1000       
   Soil      82.3            1.8e+003     1000       
   Sediment  0.000412        8.1e+003     0          
     Persistence Time: 1.07e+003 hr