CAS Number: 1733-93-3
SMILES : OCCN(CCO)CCOCCCCCCCCCCCC
CHEM   : 
MOL FOR: C18 H39 N1 O3 
MOL WT : 317.52
------------------------------ 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) =  3.63
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  421.45  (Adapted Stein & Brown method)
    Melting Pt (deg C):  153.55  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  8.38E-010  (Modified Grain method)
    VP (Pa, 25 deg C) :  1.12E-007  (Modified Grain method)
    Subcooled liquid VP: 1.72E-008 mm Hg (25 deg C, Mod-Grain method)
                       : 2.29E-006 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  79.11
       log Kow used: 3.63 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  551.8 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       Aliphatic Amines
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   3.02E-011  atm-m3/mole  (3.06E-006 Pa-m3/mole)
   Group Method:   1.99E-015  atm-m3/mole  (2.01E-010 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:  4.426E-012 atm-m3/mole  (4.484E-007 Pa-m3/mole)
      VP:   8.38E-010 mm Hg (source: MPBPVP)
      WS:   79.1 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  3.63  (KowWin est)
  Log Kaw used:  -8.908  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  12.538
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.4697
   Biowin2 (Non-Linear Model)     :   0.0442
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.8523  (weeks       )
   Biowin4 (Primary Survey Model) :   3.6199  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.8469
   Biowin6 (MITI Non-Linear Model):   0.8509
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.1860
 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):  2.29E-006 Pa (1.72E-008 mm Hg)
  Log Koa (Koawin est  ): 12.538
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.31 
       Octanol/air (Koa) model:  0.847 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.979 
       Mackay model           :  0.991 
       Octanol/air (Koa) model:  0.985 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 156.7485 E-12 cm3/molecule-sec
      Half-Life =     0.068 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     0.819 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.985 (Junge-Pankow, Mackay avg)
      0.985 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  128.3  L/kg (MCI method)
      Log Koc:  2.108       (MCI method)
      Koc    :  89.97  L/kg (Kow method)
      Log Koc:  1.954       (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 = 2.059 (BCF = 114.5 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -1.4759 days (HL = 0.03342 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.159 (BCF = 14.43)
   Log BAF Arnot-Gobas method (upper trophic) = 1.159 (BAF = 14.43)
       log Kow used: 3.63 (estimated)
 
 Volatilization from Water:
    Henry LC:  3.02E-011 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River: 3.455E+007  hours   (1.439E+006 days)
    Half-Life from Model Lake : 3.769E+008  hours   (1.57E+007 days)
 
 Removal In Wastewater Treatment:
    Total removal:              16.34  percent
    Total biodegradation:        0.21  percent
    Total sludge adsorption:    16.13  percent
    Total to Air:                0.00  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.0265          1.64         1000       
   Water     20              360          1000       
   Soil      79.8            720          1000       
   Sediment  0.139           3.24e+003    0          
     Persistence Time: 681 hr