CAS Number: 
SMILES : CCCC(CCOC)SC(=O)OCC
CHEM   : ethyl 1-(2-methoxyethyl)butylsulfanylformate
MOL FOR: C10 H20 O3 S1 
MOL WT : 220.33
------------------------------ EPI SUMMARY (v4.00) --------------------------
 Physical Property Inputs:
    Log Kow (octanol-water):   ------
    Boiling Point (deg C)  :   ------
    Melting Point (deg C)  :   ------
    Vapor Pressure (mm Hg) :   ------
    Water Solubility (mg/L):   ------
    Henry LC (atm-m3/mole) :   ------
 
 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.67 estimate) =  2.83
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  269.90  (Adapted Stein & Brown method)
    Melting Pt (deg C):  28.60  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00883  (Modified Grain method)
    VP (Pa, 25 deg C) :  1.18  (Modified Grain method)
    Subcooled liquid VP: 0.0095 mm Hg (25 deg C, Mod-Grain method)
                       : 1.27 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  131
       log Kow used: 2.83 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  489.17 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.41E-005  atm-m3/mole  (1.43E+000 Pa-m3/mole)
   Group Method:   Incomplete
 For Henry LC Comparison Purposes:
   User-Entered Henry LC:  not entered
   Henrys LC [via VP/WSol estimate using User-Entered or Estimated values]:
      HLC:  1.954E-005 atm-m3/mole  (1.980E+000 Pa-m3/mole)
      VP:   0.00883 mm Hg (source: MPBPVP)
      WS:   131 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  2.83  (KowWin est)
  Log Kaw used:  -3.239  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.069
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.2953
   Biowin2 (Non-Linear Model)     :   0.0279
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.7036  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.5201  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.2558
   Biowin6 (MITI Non-Linear Model):   0.1375
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.3042
 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):  1.27 Pa (0.0095 mm Hg)
  Log Koa (Koawin est  ): 6.069
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  2.37E-006 
       Octanol/air (Koa) model:  2.88E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  8.55E-005 
       Mackay model           :  0.000189 
       Octanol/air (Koa) model:  2.3E-005 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  29.2827 E-12 cm3/molecule-sec
      Half-Life =     0.365 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     4.383 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.000137 (Junge-Pankow, Mackay avg)
      2.3E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  43.36  L/kg (MCI method)
      Log Koc:  1.637       (MCI method)
      Koc    :  148.1  L/kg (Kow method)
      Log Koc:  2.171       (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 = 1.535 (BCF = 34.28 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.5901 days (HL = 0.257 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.624 (BCF = 42.12)
   Log BAF Arnot-Gobas method (upper trophic) = 1.624 (BAF = 42.12)
       log Kow used: 2.83 (estimated)
 
 Volatilization from Water:
    Henry LC:  1.41E-005 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      63.15  hours   (2.631 days)
    Half-Life from Model Lake :      813.4  hours   (33.89 days)
 
 Removal In Wastewater Treatment:
    Total removal:               5.22  percent
    Total biodegradation:        0.11  percent
    Total sludge adsorption:     4.34  percent
    Total to Air:                0.76  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.606           8.77         1000       
   Water     30.4            900          1000       
   Soil      68.9            1.8e+003     1000       
   Sediment  0.121           8.1e+003     0          
     Persistence Time: 745 hr