CAS Number: 
SMILES : C=C2C=CCC(C)(C)C12CCC(C)O1
CHEM   : 
MOL FOR: C13 H20 O1 
MOL WT : 192.30
------------------------------ 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) =  4.65
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  234.42  (Adapted Stein & Brown method)
    Melting Pt (deg C):  38.64  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.0693  (Modified Grain method)
    VP (Pa, 25 deg C) :  9.25  (Modified Grain method)
    Subcooled liquid VP: 0.0921 mm Hg (25 deg C, Mod-Grain method)
                       : 12.3 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  5.082
       log Kow used: 4.65 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  39.407 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Vinyl/Allyl Ethers
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   3.00E-004  atm-m3/mole  (3.04E+001 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:  3.450E-003 atm-m3/mole  (3.496E+002 Pa-m3/mole)
      VP:   0.0693 mm Hg (source: MPBPVP)
      WS:   5.08 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  4.65  (KowWin est)
  Log Kaw used:  -1.911  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.561
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :  -0.0592
   Biowin2 (Non-Linear Model)     :   0.0014
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.3413  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.2537  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.3744
   Biowin6 (MITI Non-Linear Model):   0.1704
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.9430
 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):  12.3 Pa (0.0921 mm Hg)
  Log Koa (Koawin est  ): 6.561
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  2.44E-007 
       Octanol/air (Koa) model:  8.93E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  8.82E-006 
       Mackay model           :  1.95E-005 
       Octanol/air (Koa) model:  7.15E-005 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 156.4441 E-12 cm3/molecule-sec
      Half-Life =     0.068 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     0.820 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     5.265000 E-17 cm3/molecule-sec
      Half-Life =     0.218 Days (at 7E11 mol/cm3)
      Half-Life =      5.224 Hrs
   Fraction sorbed to airborne particulates (phi):
      1.42E-005 (Junge-Pankow, Mackay avg)
      7.15E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  1275  L/kg (MCI method)
      Log Koc:  3.106       (MCI method)
      Koc    :  2550  L/kg (Kow method)
      Log Koc:  3.407       (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 = 2.737 (BCF = 546.2 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.8596 days (HL = 7.238 days)
   Log BCF Arnot-Gobas method (upper trophic) = 3.246 (BCF = 1763)
   Log BAF Arnot-Gobas method (upper trophic) = 3.288 (BAF = 1939)
       log Kow used: 4.65 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.0003 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      4.121  hours
    Half-Life from Model Lake :      161.2  hours   (6.718 days)
 
 Removal In Wastewater Treatment:
    Total removal:              66.07  percent
    Total biodegradation:        0.55  percent
    Total sludge adsorption:    61.30  percent
    Total to Air:                4.22  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.103           1.25         1000       
   Water     12.2            900          1000       
   Soil      86.8            1.8e+003     1000       
   Sediment  0.868           8.1e+003     0          
     Persistence Time: 884 hr