CAS Num: 067231-93-0
SMILES : SCCC(=O)OCCCCCCCCC
CHEM   : 
MOL FOR: C12 H24 O2 S1 
MOL WT : 232.38
------------------------------ 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) =  4.74

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  303.35  (Adapted Stein & Brown method)
    Melting Pt (deg C):  38.84  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00123  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.163  (Modified Grain method)
    Subcooled liquid VP: 0.00163 mm Hg (25 deg C, Mod-Grain method)
                       : 0.218 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  2.663
       log Kow used: 4.74 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  1.2957 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   7.97E-005  atm-m3/mole  (8.07E+000 Pa-m3/mole)
   Group Method:   1.73E-005  atm-m3/mole  (1.75E+000 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:  1.412E-004 atm-m3/mole  (1.431E+001 Pa-m3/mole)
      VP:   0.00123 mm Hg (source: MPBPVP)
      WS:   2.66 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  4.74  (KowWin est)
  Log Kaw used:  -2.487  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  7.227
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.9195
   Biowin2 (Non-Linear Model)     :   0.9964
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.1242  (weeks       )
   Biowin4 (Primary Survey Model) :   4.0105  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.8591
   Biowin6 (MITI Non-Linear Model):   0.9294
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.8705
 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):  0.217 Pa (0.00163 mm Hg)
  Log Koa (Koawin est  ): 7.227
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.38E-005 
       Octanol/air (Koa) model:  4.14E-006 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000498 
       Mackay model           :  0.0011 
       Octanol/air (Koa) model:  0.000331 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  53.4494 E-12 cm3/molecule-sec
      Half-Life =     0.200 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     2.401 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.000801 (Junge-Pankow, Mackay avg)
      0.000331 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  1296  L/kg (MCI method)
      Log Koc:  3.113       (MCI method)
      Koc    :  3029  L/kg (Kow method)
      Log Koc:  3.481       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  3.856E-002  L/mol-sec
  Kb Half-Life at pH 8:     208.057  days   
  Kb Half-Life at pH 7:       5.696  years  
    (Total Kb applies only to esters, carbmates, alkyl halides)

 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 1.418 (BCF = 26.18 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.9166 days (HL = 0.1212 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.712 (BCF = 51.53)
   Log BAF Arnot-Gobas method (upper trophic) = 1.712 (BAF = 51.53)
       log Kow used: 4.74 (estimated)

 Volatilization from Water:
    Henry LC:  1.73E-005 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      53.15  hours   (2.214 days)
    Half-Life from Model Lake :      707.6  hours   (29.48 days)

 Removal In Wastewater Treatment:
    Total removal:              67.94  percent
    Total biodegradation:        0.61  percent
    Total sludge adsorption:    67.06  percent
    Total to Air:                0.27  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.496           4.8          1000       
   Water     23.7            360          1000       
   Soil      74.7            720          1000       
   Sediment  1.05            3.24e+003    0          
     Persistence Time: 458 hr