CAS Num: 000534-15-6
SMILES : O(C(OC)C)C
CHEM   : Ethane, 1,1-dimethoxy-
MOL FOR: C4 H10 O2 
MOL WT : 90.12
------------------------------ 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) =  0.22

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  58.24  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -94.26  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  177  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  2.36E+004  (Mean VP of Antoine & Grain methods)
    MP  (exp database):  -113.2 deg C
    BP  (exp database):  64.5 deg C
    VP  (exp database):  1.71E+02 mm Hg (2.28E+004 Pa) at 25 deg C

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  8.027e+004
       log Kow used: 0.22 (estimated)
       no-melting pt equation used
     Water Sol (Exper. database match) =  1e+006 mg/L (25 deg C)
        Exper. Ref:  MERCK INDEX (1989)

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  3.276e+005 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   6.71E-005  atm-m3/mole  (6.80E+000 Pa-m3/mole)
   Group Method:   5.48E-005  atm-m3/mole  (5.55E+000 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:  2.615E-004 atm-m3/mole  (2.649E+001 Pa-m3/mole)
      VP:   177 mm Hg (source: MPBPVP)
      WS:   8.03E+004 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  0.22  (KowWin est)
  Log Kaw used:  -2.562  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  2.782
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.0099
   Biowin2 (Non-Linear Model)     :   0.0059
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.9827  (weeks       )
   Biowin4 (Primary Survey Model) :   3.6982  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.3975
   Biowin6 (MITI Non-Linear Model):   0.4178
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.0830
 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):  2.28E+004 Pa (171 mm Hg)
  Log Koa (Koawin est  ): 2.782
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.32E-010 
       Octanol/air (Koa) model:  1.49E-010 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  4.75E-009 
       Mackay model           :  1.05E-008 
       Octanol/air (Koa) model:  1.19E-008 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =   8.9269 E-12 cm3/molecule-sec
      Half-Life =     1.198 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    14.378 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      7.64E-009 (Junge-Pankow, Mackay avg)
      1.19E-008 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  2.091  L/kg (MCI method)
      Log Koc:  0.320       (MCI method)
      Koc    :  7.338  L/kg (Kow method)
      Log Koc:  0.866       (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 = 0.500 (BCF = 3.162 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -1.2021 days (HL = 0.06279 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.009 (BCF = 1.02)
   Log BAF Arnot-Gobas method (upper trophic) = 0.009 (BAF = 1.02)
       log Kow used: 0.22 (estimated)

 Volatilization from Water:
    Henry LC:  6.71E-005 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      9.252  hours
    Half-Life from Model Lake :      180.5  hours   (7.522 days)

 Removal In Wastewater Treatment:
    Total removal:               5.22  percent
    Total biodegradation:        0.09  percent
    Total sludge adsorption:     1.71  percent
    Total to Air:                3.42  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       5.61            28.9         1000       
   Water     46.4            360          1000       
   Soil      47.9            720          1000       
   Sediment  0.0889          3.24e+003    0          
     Persistence Time: 268 hr