CAS Number: 2437-56-1
SMILES : C(=C)CCCCCCCCCCC
CHEM   : 1-Tridecene
MOL FOR: C13 H26 
MOL WT : 182.35
------------------------------ EPI SUMMARY (v4.11) --------------------------
 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 v1.68 estimate) =  6.59
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  223.50  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -10.90  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.105  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  14  (Mean VP of Antoine & Grain methods)
    MP  (exp database):  -13 deg C
    BP  (exp database):  232.8 deg C
    VP  (exp database):  6.38E-02 mm Hg (8.51E+000 Pa) at 25 deg C
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  0.03674
       log Kow used: 6.59 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.013266 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   2.61E+000  atm-m3/mole  (2.64E+005 Pa-m3/mole)
   Group Method:   6.00E+000  atm-m3/mole  (6.08E+005 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:  6.857E-001 atm-m3/mole  (6.948E+004 Pa-m3/mole)
      VP:   0.105 mm Hg (source: MPBPVP)
      WS:   0.0367 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  6.59  (KowWin est)
  Log Kaw used:  2.028  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  4.562
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.7692
   Biowin2 (Non-Linear Model)     :   0.9058
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.0945  (weeks       )
   Biowin4 (Primary Survey Model) :   3.8537  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.6828
   Biowin6 (MITI Non-Linear Model):   0.8404
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.4781
 Ready Biodegradability Prediction:   YES
 
 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   1.0370
     BioHC Half-Life (days)     :  10.8887
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  8.51 Pa (0.0638 mm Hg)
  Log Koa (Koawin est  ): 4.562
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  3.53E-007 
       Octanol/air (Koa) model:  8.95E-009 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  1.27E-005 
       Mackay model           :  2.82E-005 
       Octanol/air (Koa) model:  7.16E-007 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  40.0693 E-12 cm3/molecule-sec
      Half-Life =     0.267 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     3.203 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):
      2.05E-005 (Junge-Pankow, Mackay avg)
      7.16E-007 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  8781  L/kg (MCI method)
      Log Koc:  3.944       (MCI method)
      Koc    :  5.237E+005  L/kg (Kow method)
      Log Koc:  5.719       (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 v3.01):
   Log BCF from regression-based method = 2.640 (BCF = 436.8 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.8381 days (HL = 6.889 days)
   Log BCF Arnot-Gobas method (upper trophic) = 3.069 (BCF = 1173)
   Log BAF Arnot-Gobas method (upper trophic) = 3.819 (BAF = 6595)
       log Kow used: 6.59 (estimated)
 
 Volatilization from Water:
    Henry LC:  2.61 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      1.378  hours
    Half-Life from Model Lake :      128.3  hours   (5.344 days)
 
 Removal In Wastewater Treatment (recommended maximum 95%):
    Total removal:              99.51  percent
    Total biodegradation:        0.22  percent
    Total sludge adsorption:    62.01  percent
    Total to Air:               37.29  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       5.76            5.01         1000       
   Water     70.9            360          1000       
   Soil      7.66            720          1000       
   Sediment  15.7            3.24e+003    0          
     Persistence Time: 93.1 hr