Dimethyl disulfide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Predicted data is generated using the US Environmental Protection Agency�s EPISuite™

                        
 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.67 estimate) =  1.87
    Log Kow (Exper. database match) =  1.77
       Exper. Ref:  Hansch,C et al. (1995)

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42):
    Boiling Pt (deg C):  113.62  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -69.69  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  24.5  (Mean VP of Antoine & Grain methods)
    MP  (exp database):  -85 deg C
    BP  (exp database):  109.8 deg C
    VP  (exp database):  2.87E+01 mm Hg at 25 deg C

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  3739
       log Kow used: 1.77 (expkow database)
       no-melting pt equation used
     Water Sol (Exper. database match) =  3000 mg/L (25 deg C)
        Exper. Ref:  derived from experimental HLC data

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  2867.6 mg/L
    Wat Sol (Exper. database match) =  3000.00
       Exper. Ref:  derived from experimental HLC data

 ECOSAR Class Program (ECOSAR v0.99h):
    Class(es) found:
       Neutral Organics

 Henrys Law Constant (25 deg C) [HENRYWIN v3.10]:
   Bond Method :   1.21E-003  atm-m3/mole
   Group Method:   Incomplete
   Exper Database: 1.21E-03  atm-m3/mole
 Henrys LC [VP/WSol estimate using EPI values]:  8.121E-004 atm-m3/mole

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  1.77  (exp database)
  Log Kaw used:  -1.306  (exp database)
      Log Koa (KOAWIN v1.10 estimate):  3.076
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.7027
   Biowin2 (Non-Linear Model)     :   0.8417
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.9910  (weeks       )
   Biowin4 (Primary Survey Model) :   3.7118  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.4327
   Biowin6 (MITI Non-Linear Model):   0.4614
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.6769
 Ready Biodegradability Prediction:   NO

 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   0.4288
     BioHC Half-Life (days)     :   2.6841

 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  3.83E+003 Pa (28.7 mm Hg)
  Log Koa (Koawin est  ): 3.076
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  7.84E-010 
       Octanol/air (Koa) model:  2.92E-010 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  2.83E-008 
       Mackay model           :  6.27E-008 
       Octanol/air (Koa) model:  2.34E-008 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 227.1216 E-12 cm3/molecule-sec
      Half-Life =     0.047 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     0.565 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi): 4.55E-008 (Junge,Mackay)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (PCKOCWIN v1.66):
      Koc    :  43.79
      Log Koc:  1.641 

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v1.67]:
    Rate constants can NOT be estimated for this structure!

 Bioaccumulation Estimates from Log Kow (BCFWIN v2.17):
   Log BCF from regression-based method = 0.663 (BCF = 4.602)
       log Kow used: 1.77 (expkow database)

 Volatilization from Water:
    Henry LC:  0.00121 atm-m3/mole  (Henry experimental database)
    Half-Life from Model River:       1.46  hours
    Half-Life from Model Lake :       97.3  hours   (4.054 days)

 Removal In Wastewater Treatment:
    Total removal:              34.61  percent
    Total biodegradation:        0.07  percent
    Total sludge adsorption:     1.45  percent
    Total to Air:               33.09  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       1.01            1.13         1000       
   Water     58.1            360          1000       
   Soil      40.8            720          1000       
   Sediment  0.165           3.24e+003    0          
     Persistence Time: 119 hr