CAS Number: 78204-62-3
SMILES : C=C1CCCC(C)(C)c2cc(C)ccc21
CHEM   : 
MOL FOR: C15 H20 
MOL WT : 200.33
------------------------------ EPI SUMMARY (v4.11) --------------------------
 Physical Property Inputs:
    Log Kow (octanol-water):   ------
    Boiling Point (deg C)  :   ------
    Melting Point (deg C)  :   ------
    Vapor Pressure (mm Hg) :   ------
    Water Solubility (mg/L):   ------
    Henry LC (atm-m3/mole) :   ------
 
 Log Octanol-Water Partition Coef (SRC):
    Log Kow (KOWWIN v1.68 estimate) =  6.28
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  274.31  (Adapted Stein & Brown method)
    Melting Pt (deg C):  66.05  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00311  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.415  (Modified Grain method)
    Subcooled liquid VP: 0.00755 mm Hg (25 deg C, Mod-Grain method)
                       : 1.01 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  0.1897
       log Kow used: 6.28 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.35184 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   7.22E-003  atm-m3/mole  (7.32E+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:  4.321E-003 atm-m3/mole  (4.379E+002 Pa-m3/mole)
      VP:   0.00311 mm Hg (source: MPBPVP)
      WS:   0.19 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  6.28  (KowWin est)
  Log Kaw used:  -0.530  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.810
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.5229
   Biowin2 (Non-Linear Model)     :   0.2725
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.4695  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.3367  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.3223
   Biowin6 (MITI Non-Linear Model):   0.2001
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.8224
 Ready Biodegradability Prediction:   NO
 
 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   2.0566
     BioHC Half-Life (days)     : 113.9181
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  1.01 Pa (0.00755 mm Hg)
  Log Koa (Koawin est  ): 6.810
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  2.98E-006 
       Octanol/air (Koa) model:  1.58E-006 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000108 
       Mackay model           :  0.000238 
       Octanol/air (Koa) model:  0.000127 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  66.3889 E-12 cm3/molecule-sec
      Half-Life =     0.161 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     1.933 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =    13.650000 E-17 cm3/molecule-sec
      Half-Life =     0.084 Days (at 7E11 mol/cm3)
      Half-Life =      2.015 Hrs
   Fraction sorbed to airborne particulates (phi):
      0.000173 (Junge-Pankow, Mackay avg)
      0.000127 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  1.784E+004  L/kg (MCI method)
      Log Koc:  4.251       (MCI method)
      Koc    :  2.818E+005  L/kg (Kow method)
      Log Koc:  5.450       (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 v3.01):
   Log BCF from regression-based method = 3.809 (BCF = 6443 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 1.5167 days (HL = 32.86 days)
   Log BCF Arnot-Gobas method (upper trophic) = 3.828 (BCF = 6724)
   Log BAF Arnot-Gobas method (upper trophic) = 5.422 (BAF = 2.641e+005)
       log Kow used: 6.28 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.00722 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      1.559  hours
    Half-Life from Model Lake :      135.7  hours   (5.654 days)
 
 Removal In Wastewater Treatment:
    Total removal:              93.49  percent
    Total biodegradation:        0.73  percent
    Total sludge adsorption:    90.10  percent
    Total to Air:                2.66  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.118           1.32         1000       
   Water     9.26            900          1000       
   Soil      81.9            1.8e+003     1000       
   Sediment  8.72            8.1e+003     0          
     Persistence Time: 896 hr