CAS Number: 18835-32-0
SMILES : CCCCCCCCCCCCCCCCCCCCCC=C
CHEM   : tricos-1-ene
MOL FOR: C23 H46 
MOL WT : 322.62
------------------------------ EPI SUMMARY (v4.00) --------------------------
 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 v1.67 estimate) =  11.50
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  368.36  (Adapted Stein & Brown method)
    Melting Pt (deg C):  87.74  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  2.63E-005  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.0035  (Modified Grain method)
    Subcooled liquid VP: 0.000105 mm Hg (25 deg C, Mod-Grain method)
                       : 0.014 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  3.96e-007
       log Kow used: 11.50 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  3.2262e-007 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   4.43E+001  atm-m3/mole  (4.49E+006 Pa-m3/mole)
   Group Method:   1.90E+002  atm-m3/mole  (1.92E+007 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:  2.819E+001 atm-m3/mole  (2.857E+006 Pa-m3/mole)
      VP:   2.63E-005 mm Hg (source: MPBPVP)
      WS:   3.96E-007 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  11.50  (KowWin est)
  Log Kaw used:  3.258  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  8.242
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.7024
   Biowin2 (Non-Linear Model)     :   0.5674
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.7846  (weeks       )
   Biowin4 (Primary Survey Model) :   3.6513  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.7596
   Biowin6 (MITI Non-Linear Model):   0.8707
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.7380
 Ready Biodegradability Prediction:   YES
 
 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   1.7010
     BioHC Half-Life (days)     :  50.2329
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  0.014 Pa (0.000105 mm Hg)
  Log Koa (Koawin est  ): 8.242
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  0.000214 
       Octanol/air (Koa) model:  4.29E-005 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.00768 
       Mackay model           :  0.0169 
       Octanol/air (Koa) model:  0.00342 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  54.1998 E-12 cm3/molecule-sec
      Half-Life =     0.197 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     2.368 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     1.200000 E-17 cm3/molecule-sec
      Half-Life =     0.955 Days (at 7E11 mol/cm3)
      Half-Life =     22.920 Hrs
   Fraction sorbed to airborne particulates (phi):
      0.0123 (Junge-Pankow, Mackay avg)
      0.00342 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  3.548E+006  L/kg (MCI method)
      Log Koc:  6.550       (MCI method)
      Koc    :  9.56E+009  L/kg (Kow method)
      Log Koc:  9.980       (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 = 1.322 (BCF = 21.01 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 2.2297 days (HL = 169.7 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.219 (BCF = 1.657)
   Log BAF Arnot-Gobas method (upper trophic) = 3.374 (BAF = 2368)
       log Kow used: 11.50 (estimated)
 
 Volatilization from Water:
    Henry LC:  44.3 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      1.833  hours
    Half-Life from Model Lake :      170.6  hours   (7.108 days)
 
 Removal In Wastewater Treatment:
    Total removal:              94.05  percent
    Total biodegradation:        0.78  percent
    Total sludge adsorption:    93.17  percent
    Total to Air:                0.10  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       1.33            3.92         1000       
   Water     50.3            360          1000       
   Soil      48              720          1000       
   Sediment  0.334           3.24e+003    0          
     Persistence Time: 226 hr