CAS Num: 002216-52-6
SMILES : OC(C(CCC1C)C(C)C)C1
CHEM   : Cyclohexanol, 5-methyl-2-(1-methylethyl)-,  1S-(1.alpha.,2.alpha.,5.b
         eta.) -
MOL FOR: C10 H20 O1 
MOL WT : 156.27
------------------------------ 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) =  3.38
    Log Kow (Exper. database match) =  3.40
       Exper. Ref:  GRIFFIN,S ET AL. (1999)
    Log Kow (Exper. database match) =  3.40
       Exper. Ref:  GRIFFIN,S ET AL. (1999)
    Log Kow (Exper. database match) =  3.19
       Exper. Ref:  GRIFFIN,S ET AL. (1999)

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  218.94  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -5.90  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00767  (Modified Grain method)
    VP (Pa, 25 deg C) :  1.02  (Modified Grain method)
    MP  (exp database):  79.5 deg C
    BP  (exp database):  216 deg C
    VP  (exp database):  6.37E-02 mm Hg (8.49E+000 Pa) at 25 deg C
    Subcooled liquid VP: 0.22 mm Hg (25 deg C, exp database VP )
                       : 29.4 Pa  (25 deg C, exp database VP )

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  434.5
       log Kow used: 3.19 (expkow database)
       no-melting pt equation used
     Water Sol (Exper. database match) =  456 mg/L (25 deg C)
        Exper. Ref:  YALKOWSKY,SH & DANNENFELSER,RM (1992)
     Water Sol (Exper. database match) =  420 mg/L (25 deg C)
        Exper. Ref:  WAKITA,K ET AL. (1986)
     Water Sol (Exper. database match) =  490 mg/L (25 deg C)
        Exper. Ref:  CHEMICALS INSPECTION AND TESTING INSTITU (1992)

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  941.74 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.52E-005  atm-m3/mole  (1.54E+000 Pa-m3/mole)
   Group Method:   2.56E-005  atm-m3/mole  (2.60E+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:  3.630E-006 atm-m3/mole  (3.678E-001 Pa-m3/mole)
      VP:   0.00767 mm Hg (source: MPBPVP)
      WS:   435 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  3.19  (exp database)
  Log Kaw used:  -3.207  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.397
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.8319
   Biowin2 (Non-Linear Model)     :   0.8707
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.0138  (weeks       )
   Biowin4 (Primary Survey Model) :   3.7517  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.4554
   Biowin6 (MITI Non-Linear Model):   0.3314
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.3226
 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):  29.3 Pa (0.22 mm Hg)
  Log Koa (Koawin est  ): 6.397
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.02E-007 
       Octanol/air (Koa) model:  6.12E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  3.69E-006 
       Mackay model           :  8.18E-006 
       Octanol/air (Koa) model:  4.9E-005 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  24.0849 E-12 cm3/molecule-sec
      Half-Life =     0.444 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     5.329 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      5.94E-006 (Junge-Pankow, Mackay avg)
      4.9E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  88.15  L/kg (MCI method)
      Log Koc:  1.945       (MCI method)
      Koc    :  189.7  L/kg (Kow method)
      Log Koc:  2.278       (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 = 1.772 (BCF = 59.12 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.1483 days (HL = 0.7108 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.368 (BCF = 23.36)
   Log BAF Arnot-Gobas method (upper trophic) = 1.368 (BAF = 23.36)
       log Kow used: 3.19 (expkow database)

 Volatilization from Water:
    Henry LC:  2.56E-005 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      29.87  hours   (1.244 days)
    Half-Life from Model Lake :      430.6  hours   (17.94 days)

 Removal In Wastewater Treatment:
    Total removal:               8.92  percent
    Total biodegradation:        0.14  percent
    Total sludge adsorption:     7.48  percent
    Total to Air:                1.30  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       1.2             10.7         1000       
   Water     27.8            360          1000       
   Soil      70.9            720          1000       
   Sediment  0.15            3.24e+003    0          
     Persistence Time: 417 hr