CAS Number: 603-33-8
SMILES : [Bi](c(ccc1)cc1)(c(ccc2)cc2)c(ccc3)cc3
CHEM   : BISMUTHINE, TRIPHENYL-
MOL FOR: C18 H15 Bi1 
MOL WT : 440.30
------------------------------ EPI SUMMARY (v4.10) --------------------------
 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) =  6.02
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  353.78  (Adapted Stein & Brown method)
    Melting Pt (deg C):  87.68  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  3.4E-005  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.00453  (Modified Grain method)
    MP  (exp database):  77.6 deg C
    Subcooled liquid VP: 0.000107 mm Hg (25 deg C, Mod-Grain method)
                       : 0.0143 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  0.01237
       log Kow used: 6.02 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.17185 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Neutral Organics
 
 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:  1.592E-003 atm-m3/mole  (1.613E+002 Pa-m3/mole)
      VP:   3.4E-005 mm Hg (source: MPBPVP)
      WS:   0.0124 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)         :   0.9222
   Biowin2 (Non-Linear Model)     :   0.8960
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.2922  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.2272  (weeks       )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :  -0.4745
   Biowin6 (MITI Non-Linear Model):   0.0002
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.0592
 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):  0.0143 Pa (0.000107 mm Hg)
  Log Koa (): not available
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  0.00021 
       Octanol/air (Koa) model:  not available
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.00754 
       Mackay model           :  0.0165 
       Octanol/air (Koa) model:  not available
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =   5.8495 E-12 cm3/molecule-sec
      Half-Life =     1.829 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    21.942 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.012 (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    :  3.356E+005  L/kg (MCI method)
      Log Koc:  5.526       (MCI method)
      Koc    :  1.676E+005  L/kg (Kow method)
      Log Koc:  5.224       (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 = 3.640 (BCF = 4362 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 0.0873 days (HL = 1.223 days)
   Log BCF Arnot-Gobas method (upper trophic) = 2.622 (BCF = 419.2)
   Log BAF Arnot-Gobas method (upper trophic) = 2.656 (BAF = 453.2)
       log Kow used: 6.02 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.00159 atm-m3/mole  (calculated from VP/WS)
    Half-Life from Model River:      2.913  hours
    Half-Life from Model Lake :      207.7  hours   (8.655 days)
 
 Removal In Wastewater Treatment:
    Total removal:              92.45  percent
    Total biodegradation:        0.75  percent
    Total sludge adsorption:    90.53  percent
    Total to Air:                1.17  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.875           43.9         1000       
   Water     3.86            900          1000       
   Soil      45.5            1.8e+003     1000       
   Sediment  49.8            8.1e+003     0          
     Persistence Time: 1.92e+003 hr