CAS Num: 000100-66-3
SMILES : O(c(cccc1)c1)C
CHEM   : Benzene, methoxy-
MOL FOR: C7 H8 O1 
MOL WT : 108.14
------------------------------ 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) =  2.07
    Log Kow (Exper. database match) =  2.11
       Exper. Ref:  HANSCH,C ET AL. (1995)

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  149.16  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -41.21  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  3.38  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  450  (Mean VP of Antoine & Grain methods)
    MP  (exp database):  -37.5 deg C
    BP  (exp database):  153.7 deg C
    VP  (exp database):  3.54E+00 mm Hg (4.72E+002 Pa) at 25 deg C

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  1741
       log Kow used: 2.11 (expkow database)
       no-melting pt equation used
     Water Sol (Exper. database match) =  1040 mg/L (25 deg C)
        Exper. Ref:  YALKOWSKY,SH & DANNENFELSER,RM (1992)

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  872.24 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   3.19E-004  atm-m3/mole  (3.23E+001 Pa-m3/mole)
   Group Method:   4.35E-003  atm-m3/mole  (4.41E+002 Pa-m3/mole)
   Exper Database: 4.84E-04  atm-m3/mole  (4.90E+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:  2.762E-004 atm-m3/mole  (2.799E+001 Pa-m3/mole)
      VP:   3.38 mm Hg (source: MPBPVP)
      WS:   1.74E+003 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  2.11  (exp database)
  Log Kaw used:  -1.704  (exp database)
      Log Koa (KOAWIN v1.10 estimate):  3.814
      Log Koa (experimental database):  4.010

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.9561
   Biowin2 (Non-Linear Model)     :   0.9960
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.9241  (weeks       )
   Biowin4 (Primary Survey Model) :   3.7737  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.6272
   Biowin6 (MITI Non-Linear Model):   0.7936
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.6756
 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):  472 Pa (3.54 mm Hg)
  Log Koa (Exp database): 4.010
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  6.36E-009 
       Octanol/air (Koa) model:  2.51E-009 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  2.3E-007 
       Mackay model           :  5.08E-007 
       Octanol/air (Koa) model:  2.01E-007 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  22.3336 E-12 cm3/molecule-sec
      Half-Life =     0.479 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     5.747 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      3.69E-007 (Junge-Pankow, Mackay avg)
      2.01E-007 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  93.41  L/kg (MCI method)
      Log Koc:  1.970       (MCI method)
      Koc    :  140.6  L/kg (Kow method)
      Log Koc:  2.148       (Kow method)
       Experimental Log Koc:  1.54  (database)

 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 = 1.059 (BCF = 11.46 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.6892 days (HL = 0.2045 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.067 (BCF = 11.66)
   Log BAF Arnot-Gobas method (upper trophic) = 1.067 (BAF = 11.66)
       log Kow used: 2.11 (expkow database)

 Volatilization from Water:
    Henry LC:  0.000484 atm-m3/mole  (Henry experimental database)
    Half-Life from Model River:      2.319  hours
    Half-Life from Model Lake :      112.5  hours   (4.687 days)

 Removal In Wastewater Treatment:
    Total removal:              19.58  percent
    Total biodegradation:        0.08  percent
    Total sludge adsorption:     1.96  percent
    Total to Air:               17.54  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       3.96            14.8         1000       
   Water     28.7            360          1000       
   Soil      67.2            720          1000       
   Sediment  0.161           3.24e+003    0          
     Persistence Time: 268 hr