CAS Number: 137443-18-6
SMILES : C=CCSSSSSSCC=C
CHEM   : 
MOL FOR: C6 H10 S6 
MOL WT : 274.51
------------------------------ EPI SUMMARY (v4.11) --------------------------
 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 v1.68 estimate) =  3.56
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  369.78  (Adapted Stein & Brown method)
    Melting Pt (deg C):  94.68  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  9.43E-006  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.00126  (Modified Grain method)
    Subcooled liquid VP: 4.46E-005 mm Hg (25 deg C, Mod-Grain method)
                       : 0.00594 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  15.55
       log Kow used: 3.56 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  25.501 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.19E-002  atm-m3/mole  (1.20E+003 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:  2.190E-007 atm-m3/mole  (2.219E-002 Pa-m3/mole)
      VP:   9.43E-006 mm Hg (source: MPBPVP)
      WS:   15.6 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  3.56  (KowWin est)
  Log Kaw used:  -0.313  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  3.873
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.6169
   Biowin2 (Non-Linear Model)     :   0.2913
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.5925  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.4517  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.0314
   Biowin6 (MITI Non-Linear Model):   0.0125
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.4469
 Ready Biodegradability Prediction:   NO
 
 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   0.9811
     BioHC Half-Life (days)     :   9.5749
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  0.00595 Pa (4.46E-005 mm Hg)
  Log Koa (Koawin est  ): 3.873
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  0.000504 
       Octanol/air (Koa) model:  1.83E-009 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.0179 
       Mackay model           :  0.0388 
       Octanol/air (Koa) model:  1.47E-007 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 967.1704 E-12 cm3/molecule-sec
      Half-Life =     0.011 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     7.963 Min
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     2.400000 E-17 cm3/molecule-sec
      Half-Life =     0.477 Days (at 7E11 mol/cm3)
      Half-Life =     11.460 Hrs
   Fraction sorbed to airborne particulates (phi):
      0.0283 (Junge-Pankow, Mackay avg)
      1.47E-007 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  4818  L/kg (MCI method)
      Log Koc:  3.683       (MCI method)
      Koc    :  1228  L/kg (Kow method)
      Log Koc:  3.089       (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 v3.01):
   Log BCF from regression-based method = 0.679 (BCF = 4.772 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.5039 days (HL = 0.3134 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.994 (BCF = 98.53)
   Log BAF Arnot-Gobas method (upper trophic) = 1.994 (BAF = 98.53)
       log Kow used: 3.56 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.0119 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      1.772  hours
    Half-Life from Model Lake :      158.3  hours   (6.594 days)
 
 Removal In Wastewater Treatment:
    Total removal:              83.54  percent
    Total biodegradation:        0.07  percent
    Total sludge adsorption:     8.98  percent
    Total to Air:               74.49  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.0506          0.259        1000       
   Water     15.3            900          1000       
   Soil      80.3            1.8e+003     1000       
   Sediment  4.27            8.1e+003     0          
     Persistence Time: 515 hr