CAS Number: 4696-26-8
SMILES : CCOC=CC
CHEM   : 
MOL FOR: C5 H10 O1 
MOL WT : 86.13
------------------------------ 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) =  1.33
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  80.18  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -88.37  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  161  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  2.14E+004  (Mean VP of Antoine & Grain methods)
    BP  (exp database):  67-76 deg C
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  9382
       log Kow used: 1.33 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  35500 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Vinyl/Allyl Ethers
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.19E-002  atm-m3/mole  (1.21E+003 Pa-m3/mole)
   Group Method:   5.48E-003  atm-m3/mole  (5.55E+002 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:  1.945E-003 atm-m3/mole  (1.971E+002 Pa-m3/mole)
      VP:   161 mm Hg (source: MPBPVP)
      WS:   9.38E+003 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  1.33  (KowWin est)
  Log Kaw used:  -0.313  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  1.643
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.3592
   Biowin2 (Non-Linear Model)     :   0.1619
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.0002  (weeks       )
   Biowin4 (Primary Survey Model) :   3.7137  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.5200
   Biowin6 (MITI Non-Linear Model):   0.6124
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.2986
 Ready Biodegradability Prediction:   YES
 
Hydrocarbon Biodegradation (BioHCwin v1.01):
    Structure incompatible with current estimation method!
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  2.09E+004 Pa (157 mm Hg)
  Log Koa (Koawin est  ): 1.643
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.43E-010 
       Octanol/air (Koa) model:  1.08E-011 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  5.18E-009 
       Mackay model           :  1.15E-008 
       Octanol/air (Koa) model:  8.63E-010 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  79.6294 E-12 cm3/molecule-sec [Cis-isomer]
      OVERALL OH Rate Constant =  89.5094 E-12 cm3/molecule-sec [Trans-isomer]
      Half-Life =    1.612 Hrs (12-hr day; 1.5E6 OH/cm3) [Cis-isomer]
      Half-Life =    1.434 Hrs (12-hr day; 1.5E6 OH/cm3) [Trans-isomer]
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     2.843750 E-17 cm3/molecule-sec [Cis-]
      OVERALL Ozone Rate Constant =     5.687500 E-17 cm3/molecule-sec [Trans-]
      Half-Life =     9.672 Hrs (at 7E11 mol/cm3) [Cis-isomer]
      Half-Life =     4.836 Hrs (at 7E11 mol/cm3) [Trans-isomer]
   Fraction sorbed to airborne particulates (phi):
      8.32E-009 (Junge-Pankow, Mackay avg)
      8.63E-010 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  17.68  L/kg (MCI method)
      Log Koc:  1.247       (MCI method)
      Koc    :  37.17  L/kg (Kow method)
      Log Koc:  1.570       (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 = 0.541 (BCF = 3.479 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.6618 days (HL = 0.2179 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.459 (BCF = 2.879)
   Log BAF Arnot-Gobas method (upper trophic) = 0.459 (BAF = 2.879)
       log Kow used: 1.33 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.00548 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      1.046  hours
    Half-Life from Model Lake :      89.23  hours   (3.718 days)
 
 Removal In Wastewater Treatment:
    Total removal:              68.60  percent
    Total biodegradation:        0.04  percent
    Total sludge adsorption:     0.79  percent
    Total to Air:               67.77  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.632           0.41         1000       
   Water     84.5            360          1000       
   Soil      14.6            720          1000       
   Sediment  0.217           3.24e+003    0          
     Persistence Time: 74.9 hr