CAS Num: 010236-16-5
SMILES : O=C(OCC=C(CCCC(CCCC(CCCC(C)C)C)C)C)C
CHEM   : 2-Hexadecen-1-ol, 3,7,11,15-tetramethyl-, acetate,  R- R*,R*-(E)  -
MOL FOR: C22 H42 O2 
MOL WT : 338.58
------------------------------ 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) =  9.32

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  363.22  (Adapted Stein & Brown method)
    Melting Pt (deg C):  52.10  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  3.6E-005  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.0048  (Modified Grain method)
    Subcooled liquid VP: 6.4E-005 mm Hg (25 deg C, Mod-Grain method)
                       : 0.00853 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  7.898e-005
       log Kow used: 9.32 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.00055213 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   3.96E-002  atm-m3/mole  (4.02E+003 Pa-m3/mole)
   Group Method:   8.68E-002  atm-m3/mole  (8.79E+003 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:  2.031E-001 atm-m3/mole  (2.058E+004 Pa-m3/mole)
      VP:   3.6E-005 mm Hg (source: MPBPVP)
      WS:   7.9E-005 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  9.32  (KowWin est)
  Log Kaw used:  0.209  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  9.111
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.7605
   Biowin2 (Non-Linear Model)     :   0.9072
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.5912  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.5882  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.3994
   Biowin6 (MITI Non-Linear Model):   0.3403
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.2193
 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):  0.00853 Pa (6.4E-005 mm Hg)
  Log Koa (Koawin est  ): 9.111
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  0.000352 
       Octanol/air (Koa) model:  0.000317 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.0125 
       Mackay model           :  0.0274 
       Octanol/air (Koa) model:  0.0247 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 109.9511 E-12 cm3/molecule-sec
      Half-Life =     0.097 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     1.167 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =    43.000000 E-17 cm3/molecule-sec
      Half-Life =     0.027 Days (at 7E11 mol/cm3)
      Half-Life =     38.378 Min
   Reaction With Nitrate Radicals May Be Important!
   Fraction sorbed to airborne particulates (phi):
      0.0199 (Junge-Pankow, Mackay avg)
      0.0247 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  1.575E+005  L/kg (MCI method)
      Log Koc:  5.197       (MCI method)
      Koc    :  1.034E+006  L/kg (Kow method)
      Log Koc:  6.015       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  3.467E-001  L/mol-sec
  Kb Half-Life at pH 8:      23.141  days   
  Kb Half-Life at pH 7:     231.410  days   
    (Total Kb applies only to esters, carbmates, alkyl halides)

 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 2.388 (BCF = 244.6 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.9377 days (HL = 8.664 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.948 (BCF = 8.866)
   Log BAF Arnot-Gobas method (upper trophic) = 2.977 (BAF = 948.8)
       log Kow used: 9.32 (estimated)

 Volatilization from Water:
    Henry LC:  0.0868 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:       1.89  hours
    Half-Life from Model Lake :      174.9  hours   (7.288 days)

 Removal In Wastewater Treatment:
    Total removal:              94.04  percent
    Total biodegradation:        0.78  percent
    Total sludge adsorption:    93.23  percent
    Total to Air:                0.03  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.0323          0.502        1000       
   Water     20.6            900          1000       
   Soil      77.5            1.8e+003     1000       
   Sediment  1.83            8.1e+003     0          
     Persistence Time: 898 hr