CAS Num: 058096-46-1
SMILES : O=COC(C(C(C1(C)C)CCC2(CC3)C)C1)(C2)C3
CHEM   : Tricyclo 6.3.1.02,5 dodecan-1-ol, 4,4,8-trimethyl-, formate
MOL FOR: C16 H26 O2 
MOL WT : 250.38
------------------------------ 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) =  4.86

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  292.22  (Adapted Stein & Brown method)
    Melting Pt (deg C):  83.25  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.000817  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.109  (Modified Grain method)
    Subcooled liquid VP: 0.00295 mm Hg (25 deg C, Mod-Grain method)
                       : 0.393 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  1.673
       log Kow used: 4.86 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  1.4283 mg/L

 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.09E-003  atm-m3/mole  (1.10E+002 Pa-m3/mole)
   Group Method:   8.29E-005  atm-m3/mole  (8.40E+000 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:  1.609E-004 atm-m3/mole  (1.630E+001 Pa-m3/mole)
      VP:   0.000817 mm Hg (source: MPBPVP)
      WS:   1.67 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  4.86  (KowWin est)
  Log Kaw used:  -1.351  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.211
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.2507
   Biowin2 (Non-Linear Model)     :   0.1629
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.1497  (months      )
   Biowin4 (Primary Survey Model) :   3.2551  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.6780
   Biowin6 (MITI Non-Linear Model):   0.5976
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.9947
 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):  0.393 Pa (0.00295 mm Hg)
  Log Koa (Koawin est  ): 6.211
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  7.63E-006 
       Octanol/air (Koa) model:  3.99E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000275 
       Mackay model           :  0.00061 
       Octanol/air (Koa) model:  3.19E-005 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  11.3974 E-12 cm3/molecule-sec
      Half-Life =     0.938 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    11.261 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.000443 (Junge-Pankow, Mackay avg)
      3.19E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  4859  L/kg (MCI method)
      Log Koc:  3.687       (MCI method)
      Koc    :  3530  L/kg (Kow method)
      Log Koc:  3.548       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  4.148E+000  L/mol-sec
  Kb Half-Life at pH 8:       1.934  days   
  Kb Half-Life at pH 7:      19.341  days   
    (Total Kb applies only to esters, carbmates, alkyl halides)

 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 2.872 (BCF = 744.6 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.2601 days (HL = 0.5494 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.350 (BCF = 223.7)
   Log BAF Arnot-Gobas method (upper trophic) = 2.350 (BAF = 224)
       log Kow used: 4.86 (estimated)

 Volatilization from Water:
    Henry LC:  8.29E-005 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      12.79  hours
    Half-Life from Model Lake :      272.2  hours   (11.34 days)

 Removal In Wastewater Treatment:
    Total removal:              73.24  percent
    Total biodegradation:        0.63  percent
    Total sludge adsorption:    71.63  percent
    Total to Air:                0.97  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.671           22.5         1000       
   Water     10.1            1.44e+003    1000       
   Soil      85.7            2.88e+003    1000       
   Sediment  3.6             1.3e+004     0          
     Persistence Time: 1.58e+003 hr