CAS Number: 301-10-0
SMILES : O=C(O[Sn]OC(=O)C(CC)CCCC)C(CC)CCCC
CHEM   : STANNOUS OCTOATE
MOL FOR: C16 H30 O4 Sn1 
MOL WT : 405.13
------------------------------ 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) =  2.52
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  453.32  (Adapted Stein & Brown method)
    Melting Pt (deg C):  171.21  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  1.25E-008  (Modified Grain method)
    VP (Pa, 25 deg C) :  1.67E-006  (Modified Grain method)
    Subcooled liquid VP: 4.06E-007 mm Hg (25 deg C, Mod-Grain method)
                       : 5.42E-005 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  20.1
       log Kow used: 2.52 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  2.3444 mg/L
 
 ECOSAR Class Program (ECOSAR v1.11):
    Class(es) found:
       SHOULD NOT BE PROFILED 
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   1.06E-003  atm-m3/mole  (1.08E+002 Pa-m3/mole)
   Group Method:   Incomplete
 For Henry LC Comparison Purposes:
   User-Entered Henry LC:  not entered
   Henrys LC [via VP/WSol estimate using User-Entered or Estimated values]:
      HLC:  3.315E-010 atm-m3/mole  (3.359E-005 Pa-m3/mole)
      VP:   1.25E-008 mm Hg (source: MPBPVP)
      WS:   20.1 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  2.52  (KowWin est)
  Log Kaw used:  -1.363  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  3.883
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.7715
   Biowin2 (Non-Linear Model)     :   0.7198
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.9006  (weeks       )
   Biowin4 (Primary Survey Model) :   3.8014  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :  -0.0652
   Biowin6 (MITI Non-Linear Model):   0.0000
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.2414
 Ready Biodegradability Prediction:   NO
 
Hydrocarbon Biodegradation (BioHCwin v1.01):
    Structure incompatible with current estimation method!
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  5.41E-005 Pa (4.06E-007 mm Hg)
  Log Koa (Koawin est  ): 3.883
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  0.0554 
       Octanol/air (Koa) model:  1.87E-009 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.667 
       Mackay model           :  0.816 
       Octanol/air (Koa) model:  1.5E-007 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  12.7363 E-12 cm3/molecule-sec
      Half-Life =     0.840 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    10.078 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.741 (Junge-Pankow, Mackay avg)
      1.5E-007 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  452.1  L/kg (MCI method)
      Log Koc:  2.655       (MCI method)
      Koc    :  72.51  L/kg (Kow method)
      Log Koc:  1.860       (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 = 2.729 (BCF = 535.7 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.9421 days (HL = 0.1143 days)
   Log BCF Arnot-Gobas method (upper trophic) = 1.281 (BCF = 19.08)
   Log BAF Arnot-Gobas method (upper trophic) = 1.281 (BAF = 19.08)
       log Kow used: 2.52 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.00106 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      3.166  hours
    Half-Life from Model Lake :      203.3  hours   (8.471 days)
 
 Removal In Wastewater Treatment:
    Total removal:              32.59  percent
    Total biodegradation:        0.08  percent
    Total sludge adsorption:     2.43  percent
    Total to Air:               30.08  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       2.07            20.2         1000       
   Water     15.9            360          1000       
   Soil      81.8            720          1000       
   Sediment  0.287           3.24e+003    0          
     Persistence Time: 461 hr