CAS Num: 067845-50-5
SMILES : OC(C=C(CCC=C(C)C)C)C
CHEM   : 3,7-Nonadien-2-ol, 4,8-dimethyl-
MOL FOR: C11 H20 O1 
MOL WT : 168.28
------------------------------ 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) =  3.89

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  241.21  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -12.25  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.00572  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  0.762  (Mean VP of Antoine & Grain methods)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  97.04
       log Kow used: 3.89 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  537.58 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   7.82E-005  atm-m3/mole  (7.93E+000 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:  1.305E-005 atm-m3/mole  (1.322E+000 Pa-m3/mole)
      VP:   0.00572 mm Hg (source: MPBPVP)
      WS:   97 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  3.89  (KowWin est)
  Log Kaw used:  -2.495  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.385
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.8262
   Biowin2 (Non-Linear Model)     :   0.8503
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.9873  (weeks       )
   Biowin4 (Primary Survey Model) :   3.7344  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.4348
   Biowin6 (MITI Non-Linear Model):   0.3931
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.3896
 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):  0.725 Pa (0.00544 mm Hg)
  Log Koa (Koawin est  ): 6.385
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  4.14E-006 
       Octanol/air (Koa) model:  5.96E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000149 
       Mackay model           :  0.000331 
       Octanol/air (Koa) model:  4.77E-005 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 183.6029 E-12 cm3/molecule-sec
      Half-Life =     0.058 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     0.699 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =    86.000000 E-17 cm3/molecule-sec
      Half-Life =     0.013 Days (at 7E11 mol/cm3)
      Half-Life =     19.189 Min
   Reaction With Nitrate Radicals May Be Important!
   Fraction sorbed to airborne particulates (phi):
      0.00024 (Junge-Pankow, Mackay avg)
      4.77E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  144.3  L/kg (MCI method)
      Log Koc:  2.159       (MCI method)
      Koc    :  462.7  L/kg (Kow method)
      Log Koc:  2.665       (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 = 2.232 (BCF = 170.6 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.1999 days (HL = 1.585 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.563 (BCF = 365.9)
   Log BAF Arnot-Gobas method (upper trophic) = 2.564 (BAF = 366.3)
       log Kow used: 3.89 (estimated)

 Volatilization from Water:
    Henry LC:  7.82E-005 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      11.04  hours
    Half-Life from Model Lake :      229.2  hours   (9.549 days)

 Removal In Wastewater Treatment:
    Total removal:              27.84  percent
    Total biodegradation:        0.27  percent
    Total sludge adsorption:    24.63  percent
    Total to Air:                2.94  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.0399          0.26         1000       
   Water     25.2            360          1000       
   Soil      74.6            720          1000       
   Sediment  0.189           3.24e+003    0          
     Persistence Time: 397 hr