CAS Number: 111-91-1
SMILES : O(CCCL)COCCCL
CHEM   : Ethane, 1,1'- methylenebis(oxy) bis 2-chloro-
MOL FOR: C5 H10 CL2 O2 
MOL WT : 173.04
------------------------------ 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) =  1.30
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  214.16  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -5.68  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.145  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  19.4  (Mean VP of Antoine & Grain methods)
    MP  (exp database):  -32 deg C
    BP  (exp database):  218 deg C
    VP  (exp database):  1.32E-01 mm Hg (1.76E+001 Pa) at 25 deg C
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  4658
       log Kow used: 1.30 (estimated)
       no-melting pt equation used
     Water Sol (Exper. database match) =  7800 mg/L (20 deg C)
        Exper. Ref:  BEILSTEIN
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  10752 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Halo Ethers 
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.11E-005  atm-m3/mole  (1.12E+000 Pa-m3/mole)
   Group Method:   1.69E-007  atm-m3/mole  (1.71E-002 Pa-m3/mole)
   Exper Database: 3.85E-06  atm-m3/mole  (3.90E-001 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:  7.088E-006 atm-m3/mole  (7.182E-001 Pa-m3/mole)
      VP:   0.145 mm Hg (source: MPBPVP)
      WS:   4.66E+003 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  1.30  (KowWin est)
  Log Kaw used:  -3.803  (exp database)
      Log Koa (KOAWIN v1.10 estimate):  5.103
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :  -0.2523
   Biowin2 (Non-Linear Model)     :   0.0000
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.4531  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.3774  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.4495
   Biowin6 (MITI Non-Linear Model):   0.1400
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.4222
 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):  17.6 Pa (0.132 mm Hg)
  Log Koa (Koawin est  ): 5.103
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.7E-007 
       Octanol/air (Koa) model:  3.11E-008 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  6.16E-006 
       Mackay model           :  1.36E-005 
       Octanol/air (Koa) model:  2.49E-006 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =   7.5206 E-12 cm3/molecule-sec
      Half-Life =     1.422 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    17.067 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      9.9E-006 (Junge-Pankow, Mackay avg)
      2.49E-006 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  14.38  L/kg (MCI method)
      Log Koc:  1.158       (MCI method)
      Koc    :  29.04  L/kg (Kow method)
      Log Koc:  1.463       (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 = 0.522 (BCF = 3.324 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.7867 days (HL = 0.1634 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.428 (BCF = 2.677)
   Log BAF Arnot-Gobas method (upper trophic) = 0.428 (BAF = 2.677)
       log Kow used: 1.30 (estimated)
 
 Volatilization from Water:
    Henry LC:  3.85E-006 atm-m3/mole  (Henry experimental database)
    Half-Life from Model River:      201.4  hours   (8.391 days)
    Half-Life from Model Lake :       2307  hours   (96.14 days)
 
 Removal In Wastewater Treatment:
    Total removal:               2.14  percent
    Total biodegradation:        0.09  percent
    Total sludge adsorption:     1.83  percent
    Total to Air:                0.22  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       1.8             34.1         1000       
   Water     40.2            900          1000       
   Soil      57.9            1.8e+003     1000       
   Sediment  0.104           8.1e+003     0          
     Persistence Time: 675 hr