CAS Num: 001838-59-1
SMILES : O=COCC=C
CHEM   : Formic acid, 2-propenyl ester
MOL FOR: C4 H6 O2 
MOL WT : 86.09
------------------------------ 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) =  0.67

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  78.35  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -74.65  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  75  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  1E+004  (Mean VP of Antoine & Grain methods)
    BP  (exp database):  83.6 deg C

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  3.394e+004
       log Kow used: 0.67 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  23957 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   3.15E-004  atm-m3/mole  (3.19E+001 Pa-m3/mole)
   Group Method:   2.81E-004  atm-m3/mole  (2.85E+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:  2.503E-004 atm-m3/mole  (2.536E+001 Pa-m3/mole)
      VP:   75 mm Hg (source: MPBPVP)
      WS:   3.39E+004 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  0.67  (KowWin est)
  Log Kaw used:  -1.890  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  2.560
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.8807
   Biowin2 (Non-Linear Model)     :   0.9972
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.1491  (weeks       )
   Biowin4 (Primary Survey Model) :   3.9525  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.8677
   Biowin6 (MITI Non-Linear Model):   0.9526
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.8134
 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):  9.65E+003 Pa (72.4 mm Hg)
  Log Koa (Koawin est  ): 2.560
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  3.11E-010 
       Octanol/air (Koa) model:  8.91E-011 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  1.12E-008 
       Mackay model           :  2.49E-008 
       Octanol/air (Koa) model:  7.13E-009 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  27.7944 E-12 cm3/molecule-sec
      Half-Life =     0.385 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     4.618 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):
      1.8E-008 (Junge-Pankow, Mackay avg)
      7.13E-009 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  6.638  L/kg (MCI method)
      Log Koc:  0.822       (MCI method)
      Koc    :  16.99  L/kg (Kow method)
      Log Koc:  1.230       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  4.253E+001  L/mol-sec
  Kb Half-Life at pH 8:       4.527  hours  
  Kb Half-Life at pH 7:       1.886  days   
    (Total Kb applies only to esters, carbmates, alkyl halides)

 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) = -1.9912 days (HL = 0.0102 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.014 (BCF = 1.034)
   Log BAF Arnot-Gobas method (upper trophic) = 0.014 (BAF = 1.034)
       log Kow used: 0.67 (estimated)

 Volatilization from Water:
    Henry LC:  0.000281 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:       2.88  hours
    Half-Life from Model Lake :      109.2  hours   (4.551 days)

 Removal In Wastewater Treatment:
    Total removal:              13.29  percent
    Total biodegradation:        0.08  percent
    Total sludge adsorption:     1.60  percent
    Total to Air:               11.61  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       3.26            6.58         1000       
   Water     50.4            360          1000       
   Soil      46.2            720          1000       
   Sediment  0.106           3.24e+003    0          
     Persistence Time: 176 hr