CAS Num: 001401-55-4
SMILES : O=C(c1(cc(O)c(O)c(O)c1))OC4(C(O)C(OC(=O)c2(cc(O)c(O)c(O)c2))OC(COC(=O
         )c3(cc(O)c(O)c(O)c3))C4O)
CHEM   : Tannins
MOL FOR: C27 H24 O18 
MOL WT : 636.48
------------------------------ 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) =  -0.19

 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.43):
    Boiling Pt (deg C):  920.36  (Adapted Stein & Brown method)
    Melting Pt (deg C):  349.84  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  8.82E-029  (Modified Grain method)
    VP (Pa, 25 deg C) :  1.18E-026  (Modified Grain method)
    Subcooled liquid VP: 4.52E-025 mm Hg (25 deg C, Mod-Grain method)
                       : 6.03E-023 Pa (25 deg C, Mod-Grain method)

 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  512.4
       log Kow used: -0.19 (estimated)
       no-melting pt equation used

 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.21425 mg/L

 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Esters
       Phenols, Poly 

 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   Incomplete
   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:  1.442E-031 atm-m3/mole  (1.461E-026 Pa-m3/mole)
      VP:   8.82E-029 mm Hg (source: MPBPVP)
      WS:   512 mg/L (source: WSKOWWIN)

 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Can Not Estimate (can not calculate HenryLC)

 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   1.9795
   Biowin2 (Non-Linear Model)     :   1.0000
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.0320  (weeks       )
   Biowin4 (Primary Survey Model) :   4.2227  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.9125
   Biowin6 (MITI Non-Linear Model):   0.1531
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  1.7371
 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):  6.03E-023 Pa (4.52E-025 mm Hg)
  Log Koa (): not available
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  4.98E+016 
       Octanol/air (Koa) model:  not available
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  1 
       Mackay model           :  1 
       Octanol/air (Koa) model:  not available

 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 269.8123 E-12 cm3/molecule-sec
      Half-Life =     0.040 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    28.542 Min
   Ozone Reaction:
      No Ozone Reaction Estimation
   Reaction With Nitrate Radicals May Be Important!
   Fraction sorbed to airborne particulates (phi):
      1 (Junge-Pankow, Mackay avg)
      not available (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation

 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  4.155E+004  L/kg (MCI method)
      Log Koc:  4.619       (MCI method)
      Koc    :  18.92  L/kg (Kow method)
      Log Koc:  1.277       (Kow method)

 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
  Total Kb for pH > 8 at 25 deg C :  2.507E-001  L/mol-sec
  Kb Half-Life at pH 8:      32.001  days   
  Kb Half-Life at pH 7:     320.013  days   
    (Total Kb applies only to esters, carbmates, alkyl halides)

 Bioaccumulation Estimates (BCFBAF v3.00):
   Log BCF from regression-based method = 0.500 (BCF = 3.162 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -9.5083 days (HL = 3.102e-010 days)
   Log BCF Arnot-Gobas method (upper trophic) = -0.043 (BCF = 0.9054)
   Log BAF Arnot-Gobas method (upper trophic) = -0.043 (BAF = 0.9054)
       log Kow used: -0.19 (estimated)

 Volatilization from Water:
    Henry LC:  1.44E-031 atm-m3/mole  (calculated from VP/WS)
    Half-Life from Model River: 1.025E+028  hours   (4.269E+026 days)
    Half-Life from Model Lake : 1.118E+029  hours   (4.657E+027 days)

 Removal In Wastewater Treatment:
    Total removal:               1.85  percent
    Total biodegradation:        0.09  percent
    Total sludge adsorption:     1.76  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       1.36e-005       0.951        1000       
   Water     12.7            360          1000       
   Soil      72.6            720          1000       
   Sediment  14.7            3.24e+003    0          
     Persistence Time: 906 hr