CAS Num: 026446-31-1
SMILES : O=C(OCC(O)CO)CCCC(O)CCCCC
CHEM   : Decanoic acid, 5-hydroxy-, monoester with 1,2,3-propanetriol
MOL FOR: C13 H26 O5 
MOL WT : 262.35
------------------------------ 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) =  1.15

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  388.24  (Adapted Stein & Brown method)
    Melting Pt (deg C):  127.99  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  7.22E-009  (Modified Grain method)
    VP (Pa, 25 deg C) :  9.63E-007  (Modified Grain method)
    Subcooled liquid VP: 7.72E-008 mm Hg (25 deg C, Mod-Grain method)
                       : 1.03E-005 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  2107
       log Kow used: 1.15 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  68561 mg/L

 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.46E-010  atm-m3/mole  (1.48E-005 Pa-m3/mole)
   Group Method:   1.47E-017  atm-m3/mole  (1.49E-012 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:  1.183E-012 atm-m3/mole  (1.199E-007 Pa-m3/mole)
      VP:   7.22E-009 mm Hg (source: MPBPVP)
      WS:   2.11E+003 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  1.15  (KowWin est)
  Log Kaw used:  -8.224  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  9.374
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   1.3814
   Biowin2 (Non-Linear Model)     :   0.9998
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.5379  (days-weeks  )
   Biowin4 (Primary Survey Model) :   4.3556  (hours-days  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   1.1026
   Biowin6 (MITI Non-Linear Model):   0.9836
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.9111
 Ready Biodegradability Prediction:   YES

Hydrocarbon Biodegradation (BioHCwin v1.01):
    Structure incompatible with current estimation method!

 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  1.03E-005 Pa (7.72E-008 mm Hg)
  Log Koa (Koawin est  ): 9.374
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  0.291 
       Octanol/air (Koa) model:  0.000581 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.913 
       Mackay model           :  0.959 
       Octanol/air (Koa) model:  0.0444 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  35.5616 E-12 cm3/molecule-sec
      Half-Life =     0.301 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     3.609 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.936 (Junge-Pankow, Mackay avg)
      0.0444 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  14.06  L/kg (MCI method)
      Log Koc:  1.148       (MCI method)
      Koc    :  4.707  L/kg (Kow method)
      Log Koc:  0.673       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  6.266E-002  L/mol-sec
  Kb Half-Life at pH 8:     128.021  days   
  Kb Half-Life at pH 7:       3.505  years  
    (Total Kb applies only to esters, carbmates, alkyl halides)

 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 0.425 (BCF = 2.662 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -2.6874 days (HL = 0.002054 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.075 (BCF = 1.188)
   Log BAF Arnot-Gobas method (upper trophic) = 0.075 (BAF = 1.188)
       log Kow used: 1.15 (estimated)

 Volatilization from Water:
    Henry LC:  1.46E-010 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River: 6.495E+006  hours   (2.706E+005 days)
    Half-Life from Model Lake : 7.086E+007  hours   (2.952E+006 days)

 Removal In Wastewater Treatment:
    Total removal:               1.90  percent
    Total biodegradation:        0.09  percent
    Total sludge adsorption:     1.81  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       0.0572          7.22         1000       
   Water     27.2            208          1000       
   Soil      72.7            416          1000       
   Sediment  0.0613          1.87e+003    0          
     Persistence Time: 408 hr