CAS Num: 004362-22-5
SMILES : O(C(OC1)C(c(cccc2)c2)C)C1
CHEM   : 1,3-Dioxolane, 2-(1-phenylethyl)-
MOL FOR: C11 H14 O2 
MOL WT : 178.23
------------------------------ 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) =  2.24

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  252.76  (Adapted Stein & Brown method)
    Melting Pt (deg C):  24.98  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.0235  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  3.13  (Mean VP of Antoine & Grain methods)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  692.1
       log Kow used: 2.24 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  1108.1 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   3.17E-006  atm-m3/mole  (3.21E-001 Pa-m3/mole)
   Group Method:   1.65E-007  atm-m3/mole  (1.68E-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:  7.963E-006 atm-m3/mole  (8.068E-001 Pa-m3/mole)
      VP:   0.0235 mm Hg (source: MPBPVP)
      WS:   692 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  2.24  (KowWin est)
  Log Kaw used:  -3.887  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.127
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.1507
   Biowin2 (Non-Linear Model)     :   0.0179
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.7351  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.5075  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.2685
   Biowin6 (MITI Non-Linear Model):   0.1669
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.2989
 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):  3.08 Pa (0.0231 mm Hg)
  Log Koa (Koawin est  ): 6.127
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  9.74E-007 
       Octanol/air (Koa) model:  3.29E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  3.52E-005 
       Mackay model           :  7.79E-005 
       Octanol/air (Koa) model:  2.63E-005 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  21.7388 E-12 cm3/molecule-sec
      Half-Life =     0.492 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     5.904 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      5.65E-005 (Junge-Pankow, Mackay avg)
      2.63E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  151.7  L/kg (MCI method)
      Log Koc:  2.181       (MCI method)
      Koc    :  96.14  L/kg (Kow method)
      Log Koc:  1.983       (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 = 1.142 (BCF = 13.87 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.8872 days (HL = 0.1297 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.113 (BCF = 12.96)
   Log BAF Arnot-Gobas method (upper trophic) = 1.113 (BAF = 12.96)
       log Kow used: 2.24 (estimated)

 Volatilization from Water:
    Henry LC:  3.17E-006 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      247.9  hours   (10.33 days)
    Half-Life from Model Lake :       2817  hours   (117.4 days)

 Removal In Wastewater Treatment:
    Total removal:               2.71  percent
    Total biodegradation:        0.10  percent
    Total sludge adsorption:     2.44  percent
    Total to Air:                0.18  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.531           11.8         1000       
   Water     22.4            900          1000       
   Soil      76.8            1.8e+003     1000       
   Sediment  0.209           8.1e+003     0          
     Persistence Time: 946 hr