CAS Number: 67874-82-2
SMILES : O=COC(C=C(C(CC1C2)(C3(C)C)C2)C1(C)C)C3
CHEM   : 2H-2,4a-Methanonaphthalen-7-ol, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetrame
         thyl-, formate
MOL FOR: C16 H24 O2 
MOL WT : 248.37
------------------------------ EPI SUMMARY (v4.10) --------------------------
    Henry LC (atm-m3/mole) :   ------
    Log Kow (octanol-water):   ------
    Boiling Point (deg C)  :   ------
    Water Solubility (mg/L):   ------
 Physical Property Inputs:
    Vapor Pressure (mm Hg) :   ------
    Melting Point (deg C)  :   ------
 
 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.68 estimate) =  4.70
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  291.52  (Adapted Stein & Brown method)
    Melting Pt (deg C):  87.14  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.000774  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.103  (Modified Grain method)
    Subcooled liquid VP: 0.00306 mm Hg (25 deg C, Mod-Grain method)
                       : 0.408 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  2.346
       log Kow used: 4.70 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  1.2398 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.13E-003  atm-m3/mole  (1.14E+002 Pa-m3/mole)
   Group Method:   Incomplete
 For Henry LC Comparison Purposes:
   User-Entered Henry LC:  not entered
   Henrys LC [via VP/WSol estimate using User-Entered or Estimated values]:
      HLC:  1.078E-004 atm-m3/mole  (1.092E+001 Pa-m3/mole)
      VP:   0.000774 mm Hg (source: MPBPVP)
      WS:   2.35 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  4.70  (KowWin est)
  Log Kaw used:  -1.335  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.035
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.2517
   Biowin2 (Non-Linear Model)     :   0.1668
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.1542  (months      )
   Biowin4 (Primary Survey Model) :   3.2580  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.6315
   Biowin6 (MITI Non-Linear Model):   0.4482
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.7877
 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):  0.408 Pa (0.00306 mm Hg)
  Log Koa (Koawin est  ): 6.035
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  7.35E-006 
       Octanol/air (Koa) model:  2.66E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000266 
       Mackay model           :  0.000588 
       Octanol/air (Koa) model:  2.13E-005 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  96.6663 E-12 cm3/molecule-sec
      Half-Life =     0.111 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     1.328 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     1.137500 E-17 cm3/molecule-sec
      Half-Life =     1.007 Days (at 7E11 mol/cm3)
      Half-Life =     24.179 Hrs
   Fraction sorbed to airborne particulates (phi):
      0.000427 (Junge-Pankow, Mackay avg)
      2.13E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  4436  L/kg (MCI method)
      Log Koc:  3.647       (MCI method)
      Koc    :  2879  L/kg (Kow method)
      Log Koc:  3.459       (Kow method)
 
 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  3.442E-001  L/mol-sec
  Kb Half-Life at pH 8:      23.307  days   
  Kb Half-Life at pH 7:     233.068  days   
    (Total Kb applies only to esters, carbmates, alkyl halides)
 
 Bioaccumulation Estimates (BCFBAF v3.01):
   Log BCF from regression-based method = 2.767 (BCF = 585 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.2486 days (HL = 0.5642 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.357 (BCF = 227.4)
   Log BAF Arnot-Gobas method (upper trophic) = 2.357 (BAF = 227.6)
       log Kow used: 4.70 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.00113 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      2.425  hours
    Half-Life from Model Lake :      158.6  hours   (6.608 days)
 
 Removal In Wastewater Treatment:
    Total removal:              72.30  percent
    Total biodegradation:        0.51  percent
    Total sludge adsorption:    60.54  percent
    Total to Air:               11.25  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.149           2.39         1000       
   Water     7.36            1.44e+003    1000       
   Soil      90.1            2.88e+003    1000       
   Sediment  2.39            1.3e+004     0          
     Persistence Time: 1.29e+003 hr