CAS Num: 003738-00-9
SMILES : O(C(C(C(C(C(CC1)(C)C)C2)(C1)C)C3)(C2)C)C3
CHEM   : Naphtho 2,1-b furan, dodecahydro-3a,6,6,9a-tetramethyl-
MOL FOR: C16 H28 O1 
MOL WT : 236.40
------------------------------ 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) =  4.76

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  276.83  (Adapted Stein & Brown method)
    Melting Pt (deg C):  74.13  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00393  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.524  (Modified Grain method)
    Subcooled liquid VP: 0.0115 mm Hg (25 deg C, Mod-Grain method)
                       : 1.53 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  2.436
       log Kow used: 4.76 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  3.2169 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   4.91E-004  atm-m3/mole  (4.98E+001 Pa-m3/mole)
   Group Method:   1.94E-004  atm-m3/mole  (1.97E+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:  5.018E-004 atm-m3/mole  (5.085E+001 Pa-m3/mole)
      VP:   0.00393 mm Hg (source: MPBPVP)
      WS:   2.44 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  4.76  (KowWin est)
  Log Kaw used:  -1.697  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.457
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :  -0.2641
   Biowin2 (Non-Linear Model)     :   0.0001
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.0317  (months      )
   Biowin4 (Primary Survey Model) :   3.0366  (weeks       )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.3778
   Biowin6 (MITI Non-Linear Model):   0.1500
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -1.5033
 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):  1.53 Pa (0.0115 mm Hg)
  Log Koa (Koawin est  ): 6.457
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.96E-006 
       Octanol/air (Koa) model:  7.03E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  7.07E-005 
       Mackay model           :  0.000156 
       Octanol/air (Koa) model:  5.62E-005 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  27.8938 E-12 cm3/molecule-sec
      Half-Life =     0.383 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     4.601 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.000114 (Junge-Pankow, Mackay avg)
      5.62E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  6900  L/kg (MCI method)
      Log Koc:  3.839       (MCI method)
      Koc    :  2934  L/kg (Kow method)
      Log Koc:  3.467       (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 = 2.805 (BCF = 638.8 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.7271 days (HL = 5.335 days)
   Log BCF Arnot-Gobas method (upper trophic) = 3.193 (BCF = 1561)
   Log BAF Arnot-Gobas method (upper trophic) = 3.224 (BAF = 1675)
       log Kow used: 4.76 (estimated)

 Volatilization from Water:
    Henry LC:  0.000491 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      3.402  hours
    Half-Life from Model Lake :        166  hours   (6.918 days)

 Removal In Wastewater Treatment:
    Total removal:              71.48  percent
    Total biodegradation:        0.57  percent
    Total sludge adsorption:    65.59  percent
    Total to Air:                5.32  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.415           9.2          1000       
   Water     7.19            1.44e+003    1000       
   Soil      88.7            2.88e+003    1000       
   Sediment  3.72            1.3e+004     0          
     Persistence Time: 1.48e+003 hr