CAS Num: 007493-74-5
SMILES : O=C(OCC=C)COc(cccc1)c1
CHEM   : Acetic acid, phenoxy-, 2-propenyl ester
MOL FOR: C11 H12 O3 
MOL WT : 192.22
------------------------------ 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) =  2.46

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  268.49  (Adapted Stein & Brown method)
    Melting Pt (deg C):  36.45  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00807  (Modified Grain method)
    VP (Pa, 25 deg C) :  1.08  (Modified Grain method)
    Subcooled liquid VP: 0.0102 mm Hg (25 deg C, Mod-Grain method)
                       : 1.36 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  379.6
       log Kow used: 2.46 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  147.89 mg/L

 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters
       Vinyl/Allyl Esters

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   7.05E-006  atm-m3/mole  (7.15E-001 Pa-m3/mole)
   Group Method:   4.15E-005  atm-m3/mole  (4.21E+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:  5.377E-006 atm-m3/mole  (5.448E-001 Pa-m3/mole)
      VP:   0.00807 mm Hg (source: MPBPVP)
      WS:   380 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  2.46  (KowWin est)
  Log Kaw used:  -3.540  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.000
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   1.0902
   Biowin2 (Non-Linear Model)     :   0.9998
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.8785  (weeks       )
   Biowin4 (Primary Survey Model) :   3.8814  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.8378
   Biowin6 (MITI Non-Linear Model):   0.9081
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.7584
 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):  1.36 Pa (0.0102 mm Hg)
  Log Koa (Koawin est  ): 6.000
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  2.21E-006 
       Octanol/air (Koa) model:  2.45E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  7.97E-005 
       Mackay model           :  0.000176 
       Octanol/air (Koa) model:  1.96E-005 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  51.0646 E-12 cm3/molecule-sec
      Half-Life =     0.209 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     2.514 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     1.200000 E-17 cm3/molecule-sec
      Half-Life =     0.955 Days (at 7E11 mol/cm3)
      Half-Life =     22.920 Hrs
   Fraction sorbed to airborne particulates (phi):
      0.000128 (Junge-Pankow, Mackay avg)
      1.96E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  152.1  L/kg (MCI method)
      Log Koc:  2.182       (MCI method)
      Koc    :  188.9  L/kg (Kow method)
      Log Koc:  2.276       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  1.206E+001  L/mol-sec
  Kb Half-Life at pH 8:      15.959  hours  
  Kb Half-Life at pH 7:       6.649  days   
    (Total Kb applies only to esters, carbmates, alkyl halides)

 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 1.290 (BCF = 19.51 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -1.4579 days (HL = 0.03484 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.956 (BCF = 9.042)
   Log BAF Arnot-Gobas method (upper trophic) = 0.956 (BAF = 9.042)
       log Kow used: 2.46 (estimated)

 Volatilization from Water:
    Henry LC:  7.05E-006 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      116.6  hours   (4.856 days)
    Half-Life from Model Lake :       1388  hours   (57.82 days)

 Removal In Wastewater Treatment:
    Total removal:               3.37  percent
    Total biodegradation:        0.10  percent
    Total sludge adsorption:     2.88  percent
    Total to Air:                0.39  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.441           4.12         1000       
   Water     26.9            360          1000       
   Soil      72.5            720          1000       
   Sediment  0.209           3.24e+003    0          
     Persistence Time: 441 hr