CAS Number: 
SMILES : CCCCC(=O)OCc1ccc(cc1)OC
CHEM   : (4-methoxyphenyl)methyl pentanoate
MOL FOR: C13 H18 O3 
MOL WT : 222.29
------------------------------ EPI SUMMARY (v4.00) --------------------------
 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 v1.67 estimate) =  3.64
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  300.79  (Adapted Stein & Brown method)
    Melting Pt (deg C):  64.29  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.000803  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.107  (Modified Grain method)
    Subcooled liquid VP: 0.00187 mm Hg (25 deg C, Mod-Grain method)
                       : 0.249 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  26.32
       log Kow used: 3.64 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  14.318 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.96E-006  atm-m3/mole  (1.99E-001 Pa-m3/mole)
   Group Method:   3.46E-006  atm-m3/mole  (3.50E-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:  8.924E-006 atm-m3/mole  (9.042E-001 Pa-m3/mole)
      VP:   0.000803 mm Hg (source: MPBPVP)
      WS:   26.3 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  3.64  (KowWin est)
  Log Kaw used:  -4.096  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  7.736
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   1.0562
   Biowin2 (Non-Linear Model)     :   0.9997
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.0884  (weeks       )
   Biowin4 (Primary Survey Model) :   4.1022  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.7160
   Biowin6 (MITI Non-Linear Model):   0.8265
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.3980
 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):  0.249 Pa (0.00187 mm Hg)
  Log Koa (Koawin est  ): 7.736
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.2E-005 
       Octanol/air (Koa) model:  1.34E-005 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000434 
       Mackay model           :  0.000962 
       Octanol/air (Koa) model:  0.00107 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  31.6080 E-12 cm3/molecule-sec
      Half-Life =     0.338 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     4.061 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.000698 (Junge-Pankow, Mackay avg)
      0.00107 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  465.3  L/kg (MCI method)
      Log Koc:  2.668       (MCI method)
      Koc    :  848.8  L/kg (Kow method)
      Log Koc:  2.929       (Kow method)
 
 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  2.098E-001  L/mol-sec
  Kb Half-Life at pH 8:      38.228  days   
  Kb Half-Life at pH 7:       1.047  years  
    (Total Kb applies only to esters, carbmates, alkyl halides)
 
 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 2.065 (BCF = 116.3 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.9216 days (HL = 0.1198 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.663 (BCF = 45.99)
   Log BAF Arnot-Gobas method (upper trophic) = 1.663 (BAF = 45.99)
       log Kow used: 3.64 (estimated)
 
 Volatilization from Water:
    Henry LC:  3.46E-006 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      253.8  hours   (10.58 days)
    Half-Life from Model Lake :       2894  hours   (120.6 days)
 
 Removal In Wastewater Treatment:
    Total removal:              16.78  percent
    Total biodegradation:        0.21  percent
    Total sludge adsorption:    16.40  percent
    Total to Air:                0.16  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.762           8.12         1000       
   Water     25.1            360          1000       
   Soil      73.7            720          1000       
   Sediment  0.465           3.24e+003    0          
     Persistence Time: 461 hr