CAS Number: 34314-83-5
SMILES : O(C=C1C)CC1
CHEM   : FURAN, 2,3-DIHYDRO-4-METHYL-
MOL FOR: C5 H8 O1 
MOL WT : 84.12
------------------------------ 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) =  1.27
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  95.16  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -65.08  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  52.6  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  7.01E+003  (Mean VP of Antoine & Grain methods)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.41):
    Water Solubility at 25 deg C (mg/L):  1.059e+004
       log Kow used: 1.27 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  54521 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Vinyl/Allyl Ethers
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   6.21E-003  atm-m3/mole  (6.29E+002 Pa-m3/mole)
   Group Method:   7.92E-004  atm-m3/mole  (8.02E+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:  5.498E-004 atm-m3/mole  (5.570E+001 Pa-m3/mole)
      VP:   52.6 mm Hg (source: MPBPVP)
      WS:   1.06E+004 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  1.27  (KowWin est)
  Log Kaw used:  -0.595  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  1.865
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.3601
   Biowin2 (Non-Linear Model)     :   0.1659
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   3.0046  (weeks       )
   Biowin4 (Primary Survey Model) :   3.7166  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.5094
   Biowin6 (MITI Non-Linear Model):   0.6251
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.1857
 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):  6.71E+003 Pa (50.3 mm Hg)
  Log Koa (Koawin est  ): 1.865
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  4.47E-010 
       Octanol/air (Koa) model:  1.8E-011 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  1.62E-008 
       Mackay model           :  3.58E-008 
       Octanol/air (Koa) model:  1.44E-009 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant = 119.6832 E-12 cm3/molecule-sec
      Half-Life =     0.089 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     1.072 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =    36.968750 E-17 cm3/molecule-sec
      Half-Life =     0.031 Days (at 7E11 mol/cm3)
      Half-Life =     44.639 Min
   Fraction sorbed to airborne particulates (phi):
      2.6E-008 (Junge-Pankow, Mackay avg)
      1.44E-009 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  17.25  L/kg (MCI method)
      Log Koc:  1.237       (MCI method)
      Koc    :  34.43  L/kg (Kow method)
      Log Koc:  1.537       (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 = 0.504 (BCF = 3.194 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -0.8495 days (HL = 0.1414 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.404 (BCF = 2.536)
   Log BAF Arnot-Gobas method (upper trophic) = 0.404 (BAF = 2.536)
       log Kow used: 1.27 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.000792 atm-m3/mole  (estimated by Group SAR Method)
    Half-Life from Model River:      1.614  hours
    Half-Life from Model Lake :      94.51  hours   (3.938 days)
 
 Removal In Wastewater Treatment:
    Total removal:              26.60  percent
    Total biodegradation:        0.07  percent
    Total sludge adsorption:     1.44  percent
    Total to Air:               25.09  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       0.443           0.552        1000       
   Water     55.9            360          1000       
   Soil      43.5            720          1000       
   Sediment  0.143           3.24e+003    0          
     Persistence Time: 131 hr