CAS Num: 001653-30-1
SMILES : OC(CCCCCCCCC)C
CHEM   : 2-Undecanol
MOL FOR: C11 H24 O1 
MOL WT : 172.31
------------------------------ 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) =  4.21

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  239.95  (Adapted Stein & Brown method)
    Melting Pt (deg C):  6.42  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.0062  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  0.826  (Mean VP of Antoine & Grain methods)
    VP  (exp database):  3.34E-02 mm Hg (4.45E+000 Pa) at 25 deg C

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  49.73
       log Kow used: 4.21 (estimated)
       no-melting pt equation used
     Water Sol (Exper. database match) =  197 mg/L (25 deg C)
        Exper. Ref:  SUZUKI,T (1991)

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  41.645 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   7.26E-005  atm-m3/mole  (7.35E+000 Pa-m3/mole)
   Group Method:   1.81E-004  atm-m3/mole  (1.84E+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:  2.827E-005 atm-m3/mole  (2.864E+000 Pa-m3/mole)
      VP:   0.0062 mm Hg (source: MPBPVP)
      WS:   49.7 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  4.21  (KowWin est)
  Log Kaw used:  -2.528  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.738
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.9327
   Biowin2 (Non-Linear Model)     :   0.9713
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.2767  (days-weeks  )
   Biowin4 (Primary Survey Model) :   3.9977  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.7061
   Biowin6 (MITI Non-Linear Model):   0.8733
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.5340
 Ready Biodegradability Prediction:   YES

Hydrocarbon Biodegradation (BioHCwin v1.01):
    Structure incompatible with current estimation method!

 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  4.45 Pa (0.0334 mm Hg)
  Log Koa (Koawin est  ): 6.738
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  6.74E-007 
       Octanol/air (Koa) model:  1.34E-006 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  2.43E-005 
       Mackay model           :  5.39E-005 
       Octanol/air (Koa) model:  0.000107 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  19.8664 E-12 cm3/molecule-sec
      Half-Life =     0.538 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     6.461 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      3.91E-005 (Junge-Pankow, Mackay avg)
      0.000107 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  194.9  L/kg (MCI method)
      Log Koc:  2.290       (MCI method)
      Koc    :  695.6  L/kg (Kow method)
      Log Koc:  2.842       (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 = 1.067 (BCF = 11.68 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.2215 days (HL = 0.6005 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.344 (BCF = 221)
   Log BAF Arnot-Gobas method (upper trophic) = 2.344 (BAF = 221)
       log Kow used: 4.21 (estimated)

 Volatilization from Water:
    Henry LC:  7.26E-005 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      11.93  hours
    Half-Life from Model Lake :      240.2  hours   (10.01 days)

 Removal In Wastewater Treatment:
    Total removal:              42.11  percent
    Total biodegradation:        0.39  percent
    Total sludge adsorption:    39.57  percent
    Total to Air:                2.15  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       2.29            12.9         1000       
   Water     26.7            208          1000       
   Soil      70.8            416          1000       
   Sediment  0.203           1.87e+003    0          
     Persistence Time: 264 hr