CAS Num: 001883-78-9
SMILES : o1cccc1CSC(C)C
CHEM   : Furan, 2-  (1-methylethyl)thio methyl -
MOL FOR: C8 H12 O1 S1 
MOL WT : 156.24
------------------------------ 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) =  2.91

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  201.35  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -7.09  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.337  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  45  (Mean VP of Antoine & Grain methods)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  235.1
       log Kow used: 2.91 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  285.04 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.12E-004  atm-m3/mole  (1.13E+001 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:  2.947E-004 atm-m3/mole  (2.986E+001 Pa-m3/mole)
      VP:   0.337 mm Hg (source: MPBPVP)
      WS:   235 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  2.91  (KowWin est)
  Log Kaw used:  -2.339  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  5.249
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.6732
   Biowin2 (Non-Linear Model)     :   0.6878
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.8539  (weeks       )
   Biowin4 (Primary Survey Model) :   3.6223  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.1664
   Biowin6 (MITI Non-Linear Model):   0.1406
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.2175
 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):  41.2 Pa (0.309 mm Hg)
  Log Koa (Koawin est  ): 5.249
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  7.28E-008 
       Octanol/air (Koa) model:  4.36E-008 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  2.63E-006 
       Mackay model           :  5.83E-006 
       Octanol/air (Koa) model:  3.48E-006 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 125.0881 E-12 cm3/molecule-sec
      Half-Life =     0.086 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     1.026 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Reaction With Nitrate Radicals May Be Important!
   Fraction sorbed to airborne particulates (phi):
      4.23E-006 (Junge-Pankow, Mackay avg)
      3.48E-006 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  1246  L/kg (MCI method)
      Log Koc:  3.096       (MCI method)
      Koc    :  335.1  L/kg (Kow method)
      Log Koc:  2.525       (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 = 1.584 (BCF = 38.36 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.6403 days (HL = 0.2289 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.645 (BCF = 44.12)
   Log BAF Arnot-Gobas method (upper trophic) = 1.645 (BAF = 44.12)
       log Kow used: 2.91 (estimated)

 Volatilization from Water:
    Henry LC:  0.000112 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:       7.81  hours
    Half-Life from Model Lake :        190  hours   (7.917 days)

 Removal In Wastewater Treatment:
    Total removal:              10.05  percent
    Total biodegradation:        0.11  percent
    Total sludge adsorption:     4.72  percent
    Total to Air:                5.21  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.272           2.05         1000       
   Water     20.9            360          1000       
   Soil      77.9            720          1000       
   Sediment  0.895           3.24e+003    0          
     Persistence Time: 433 hr