CAS Number: 7116-95-2
SMILES : c1ccccc1c2ccc(C(C)C)cc2
CHEM   : 4-Isopropylbiphenyl
MOL FOR: C15 H16 
MOL WT : 196.29
------------------------------ 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) =  5.21
    Log Kow (Exper. database match) =  5.51
       Exper. Ref:  TSCATS
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  308.97  (Adapted Stein & Brown method)
    Melting Pt (deg C):  43.69  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  0.000818  (Modified Grain method)
    VP (Pa, 25 deg C) :  0.109  (Modified Grain method)
    Subcooled liquid VP: 0.00121 mm Hg (25 deg C, Mod-Grain method)
                       : 0.161 Pa (25 deg C, Mod-Grain method)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  0.9002
       log Kow used: 5.51 (expkow database)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  0.53509 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   8.05E-004  atm-m3/mole  (8.15E+001 Pa-m3/mole)
   Group Method:   9.74E-004  atm-m3/mole  (9.87E+001 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:  2.347E-004 atm-m3/mole  (2.378E+001 Pa-m3/mole)
      VP:   0.000818 mm Hg (source: MPBPVP)
      WS:   0.9 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  5.51  (exp database)
  Log Kaw used:  -1.483  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  6.993
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.8369
   Biowin2 (Non-Linear Model)     :   0.9307
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.7125  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.5009  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.1932
   Biowin6 (MITI Non-Linear Model):   0.1470
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.0451
 Ready Biodegradability Prediction:   NO
 
 Hydrocarbon Biodegradation (BioHCwin v1.01):
     LOG BioHC Half-Life (days) :   1.8607
     BioHC Half-Life (days)     :  72.5665
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  0.161 Pa (0.00121 mm Hg)
  Log Koa (Koawin est  ): 6.993
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.86E-005 
       Octanol/air (Koa) model:  2.42E-006 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  0.000671 
       Mackay model           :  0.00149 
       Octanol/air (Koa) model:  0.000193 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =   9.7382 E-12 cm3/molecule-sec
      Half-Life =     1.098 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    13.180 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      0.00108 (Junge-Pankow, Mackay avg)
      0.000193 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  2.455E+004  L/kg (MCI method)
      Log Koc:  4.390       (MCI method)
      Koc    :  6.05E+004  L/kg (Kow method)
      Log Koc:  4.782       (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 = 3.302 (BCF = 2007 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = 1.1206 days (HL = 13.2 days)
   Log BCF Arnot-Gobas method (upper trophic) = 3.597 (BCF = 3954)
   Log BAF Arnot-Gobas method (upper trophic) = 4.062 (BAF = 1.154e+004)
       log Kow used: 5.51 (expkow database)
 
 Volatilization from Water:
    Henry LC:  0.000974 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      2.272  hours
    Half-Life from Model Lake :      142.3  hours   (5.928 days)
 
 Removal In Wastewater Treatment:
    Total removal:              88.99  percent
    Total biodegradation:        0.72  percent
    Total sludge adsorption:    86.00  percent
    Total to Air:                2.27  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       1.29            26.4         1000       
   Water     8.18            900          1000       
   Soil      79.2            1.8e+003     1000       
   Sediment  11.3            8.1e+003     0          
     Persistence Time: 1.07e+003 hr