CAS Number: 24070-77-7
SMILES : OC(CC1)C(C1)C
CHEM   : CYCLOPENTANOL, 2-METHYL-
MOL FOR: C6 H12 O1 
MOL WT : 100.16
------------------------------ EPI SUMMARY (v4.00) --------------------------
 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 v1.67 estimate) =  1.56
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  153.43  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -36.19  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  1.47  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  196  (Mean VP of Antoine & Grain methods)
    BP  (exp database):  148.5 deg C
 
 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  1.746e+004
       log Kow used: 1.56 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  30223 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   4.90E-006  atm-m3/mole  (4.96E-001 Pa-m3/mole)
   Group Method:   4.45E-006  atm-m3/mole  (4.51E-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:  1.110E-005 atm-m3/mole  (1.124E+000 Pa-m3/mole)
      VP:   1.47 mm Hg (source: MPBPVP)
      WS:   1.75E+004 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  1.56  (KowWin est)
  Log Kaw used:  -3.698  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  5.258
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.8586
   Biowin2 (Non-Linear Model)     :   0.9373
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.1378  (weeks       )
   Biowin4 (Primary Survey Model) :   3.8327  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.6598
   Biowin6 (MITI Non-Linear Model):   0.7518
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.6081
 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):  176 Pa (1.32 mm Hg)
  Log Koa (Koawin est  ): 5.258
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.7E-008 
       Octanol/air (Koa) model:  4.45E-008 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  6.16E-007 
       Mackay model           :  1.36E-006 
       Octanol/air (Koa) model:  3.56E-006 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  11.4732 E-12 cm3/molecule-sec
      Half-Life =     0.932 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =    11.187 Hrs
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      9.9E-007 (Junge-Pankow, Mackay avg)
      3.56E-006 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  10.11  L/kg (MCI method)
      Log Koc:  1.005       (MCI method)
      Koc    :  23.8  L/kg (Kow method)
      Log Koc:  1.377       (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 v3.00):
   Log BCF from regression-based method = 0.699 (BCF = 4.998 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.8158 days (HL = 0.1528 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.612 (BCF = 4.095)
   Log BAF Arnot-Gobas method (upper trophic) = 0.612 (BAF = 4.095)
       log Kow used: 1.56 (estimated)
 
 Volatilization from Water:
    Henry LC:  4.45E-006 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      132.7  hours   (5.529 days)
    Half-Life from Model Lake :       1532  hours   (63.81 days)
 
 Removal In Wastewater Treatment:
    Total removal:               2.24  percent
    Total biodegradation:        0.09  percent
    Total sludge adsorption:     1.89  percent
    Total to Air:                0.25  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       2.32            22.4         1000       
   Water     39.4            360          1000       
   Soil      58.2            720          1000       
   Sediment  0.0888          3.24e+003    0          
     Persistence Time: 375 hr