CAS Num: 068845-01-2
SMILES : O(C1(C(C(CC2)(C)C)CCC3(O)C)C3)C12
CHEM   : 3H-Naphth[1,8a-b]oxiren-7-ol, octahydro-4,4,7-trimethyl-
MOL FOR: C13 H22 O2 
MOL WT : 210.32
------------------------------ 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) =  2.50

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  273.13  (Adapted Stein & Brown method)
    Melting Pt (deg C):  74.49  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.000253  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.0337  (Modified Grain method)
    Subcooled liquid VP: 0.000745 mm Hg (25 deg C, Mod-Grain method)
                       : 0.0993 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  913.1
       log Kow used: 2.50 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  1098.6 mg/L

 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Epoxides, mono

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.93E-008  atm-m3/mole  (1.95E-003 Pa-m3/mole)
   Group Method:   9.74E-010  atm-m3/mole  (9.87E-005 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:  7.668E-008 atm-m3/mole  (7.769E-003 Pa-m3/mole)
      VP:   0.000253 mm Hg (source: MPBPVP)
      WS:   913 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  2.50  (KowWin est)
  Log Kaw used:  -6.103  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  8.603
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :  -0.2517
   Biowin2 (Non-Linear Model)     :   0.0002
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.0894  (months      )
   Biowin4 (Primary Survey Model) :   3.0742  (weeks       )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.4155
   Biowin6 (MITI Non-Linear Model):   0.1863
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -1.1837
 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):  0.0993 Pa (0.000745 mm Hg)
  Log Koa (Koawin est  ): 8.603
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  3.02E-005 
       Octanol/air (Koa) model:  9.84E-005 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.00109 
       Mackay model           :  0.00241 
       Octanol/air (Koa) model:  0.00781 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  33.3097 E-12 cm3/molecule-sec
      Half-Life =     0.321 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     3.853 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.00175 (Junge-Pankow, Mackay avg)
      0.00781 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  96.75  L/kg (MCI method)
      Log Koc:  1.986       (MCI method)
      Koc    :  63.96  L/kg (Kow method)
      Log Koc:  1.806       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Ka (acid-catalyzed) at 25 deg C :  9.605E-001  L/mol-sec
  Ka Half-Life at pH 7:      83.518  days   
    (Total Ka applies to epoxide(s) only)

 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 1.318 (BCF = 20.81 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.3363 days (HL = 0.461 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.456 (BCF = 28.61)
   Log BAF Arnot-Gobas method (upper trophic) = 1.456 (BAF = 28.61)
       log Kow used: 2.50 (estimated)

 Volatilization from Water:
    Henry LC:  1.93E-008 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:   4.4E+004  hours   (1833 days)
    Half-Life from Model Lake : 4.801E+005  hours   (2E+004 days)

 Removal In Wastewater Treatment:
    Total removal:               3.10  percent
    Total biodegradation:        0.10  percent
    Total sludge adsorption:     2.99  percent
    Total to Air:                0.00  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.0814          7.71         1000       
   Water     18.3            1.44e+003    1000       
   Soil      81.5            2.88e+003    1000       
   Sediment  0.125           1.3e+004     0          
     Persistence Time: 1.82e+003 hr