CAS Num: 010519-33-2
SMILES : O=C(C=CCCCCCC)C
CHEM   : 3-Decen-2-one
MOL FOR: C10 H18 O1 
MOL WT : 154.25
------------------------------ 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) =  3.28

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  210.81  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -8.21  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.308  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  41.1  (Mean VP of Antoine & Grain methods)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  115.7
       log Kow used: 3.28 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  30.971 mg/L

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

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.69E-004  atm-m3/mole  (1.71E+001 Pa-m3/mole)
   Group Method:   9.09E-005  atm-m3/mole  (9.21E+000 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:  5.403E-004 atm-m3/mole  (5.475E+001 Pa-m3/mole)
      VP:   0.308 mm Hg (source: MPBPVP)
      WS:   116 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  3.28  (KowWin est)
  Log Kaw used:  -2.161  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  5.441
      Log Koa (experimental database):  None

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.7894
   Biowin2 (Non-Linear Model)     :   0.9011
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.1341  (weeks       )
   Biowin4 (Primary Survey Model) :   3.8720  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.6313
   Biowin6 (MITI Non-Linear Model):   0.7594
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.0498
 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):  38 Pa (0.285 mm Hg)
  Log Koa (Koawin est  ): 5.441
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  7.89E-008 
       Octanol/air (Koa) model:  6.78E-008 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  2.85E-006 
       Mackay model           :  6.32E-006 
       Octanol/air (Koa) model:  5.42E-006 

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  57.5661 E-12 cm3/molecule-sec [Cis-isomer]
      OVERALL OH Rate Constant =  64.4061 E-12 cm3/molecule-sec [Trans-isomer]
      Half-Life =    2.230 Hrs (12-hr day; 1.5E6 OH/cm3) [Cis-isomer]
      Half-Life =    1.993 Hrs (12-hr day; 1.5E6 OH/cm3) [Trans-isomer]
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     1.535625 E-17 cm3/molecule-sec [Cis-]
      OVERALL Ozone Rate Constant =     3.071250 E-17 cm3/molecule-sec [Trans-]
      Half-Life =    17.911 Hrs (at 7E11 mol/cm3) [Cis-isomer]
      Half-Life =     8.955 Hrs (at 7E11 mol/cm3) [Trans-isomer]
   Fraction sorbed to airborne particulates (phi):
      4.58E-006 (Junge-Pankow, Mackay avg)
      5.42E-006 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  165.2  L/kg (MCI method)
      Log Koc:  2.218       (MCI method)
      Koc    :  860.9  L/kg (Kow method)
      Log Koc:  2.935       (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 = 1.829 (BCF = 67.41 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.2628 days (HL = 0.546 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.026 (BCF = 106.3)
   Log BAF Arnot-Gobas method (upper trophic) = 2.026 (BAF = 106.3)
       log Kow used: 3.28 (estimated)

 Volatilization from Water:
    Henry LC:  9.09E-005 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      9.267  hours
    Half-Life from Model Lake :      205.2  hours   (8.551 days)

 Removal In Wastewater Treatment:
    Total removal:              12.86  percent
    Total biodegradation:        0.14  percent
    Total sludge adsorption:     8.56  percent
    Total to Air:                4.15  percent
      (using 10000 hr Bio P,A,S)

 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.526           3.57         1000       
   Water     24.5            360          1000       
   Soil      74.8            720          1000       
   Sediment  0.203           3.24e+003    0          
     Persistence Time: 398 hr