CAS Number: 2680-03-7
SMILES : O=C(N(C)C)C=C
CHEM   : 2-Propenamide, N,N-dimethyl-
MOL FOR: C5 H9 N1 O1 
MOL WT : 99.13
------------------------------ 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) =  -0.13
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
    Boiling Pt (deg C):  158.72  (Adapted Stein & Brown method)
    Melting Pt (deg C):  -17.72  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  2.67  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  356  (Mean VP of Antoine & Grain methods)
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    Water Solubility at 25 deg C (mg/L):  1.52e+005
       log Kow used: -0.13 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    Wat Sol (v1.01 est) =  3.0277e+005 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Acrylamides
       Amides 
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   Bond Method :   2.84E-008  atm-m3/mole  (2.88E-003 Pa-m3/mole)
   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:  2.291E-006 atm-m3/mole  (2.322E-001 Pa-m3/mole)
      VP:   2.67 mm Hg (source: MPBPVP)
      WS:   1.52E+005 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
  Log Kow used:  -0.13  (KowWin est)
  Log Kaw used:  -5.935  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  5.805
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
   Biowin1 (Linear Model)         :   0.9105
   Biowin2 (Non-Linear Model)     :   0.9865
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.9259  (weeks       )
   Biowin4 (Primary Survey Model) :   3.9101  (days        )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :   0.5632
   Biowin6 (MITI Non-Linear Model):   0.6624
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model): -0.1115
 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):  324 Pa (2.43 mm Hg)
  Log Koa (Koawin est  ): 5.805
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  9.26E-009 
       Octanol/air (Koa) model:  1.57E-007 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  3.34E-007 
       Mackay model           :  7.41E-007 
       Octanol/air (Koa) model:  1.25E-005 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =  25.3202 E-12 cm3/molecule-sec
      Half-Life =     0.422 Days (12-hr day; 1.5E6 OH/cm3)
      Half-Life =     5.069 Hrs
   Ozone Reaction:
      OVERALL Ozone Rate Constant =     0.175000 E-17 cm3/molecule-sec
      Half-Life =     6.549 Days (at 7E11 mol/cm3)
   Fraction sorbed to airborne particulates (phi):
      5.38E-007 (Junge-Pankow, Mackay avg)
      1.25E-005 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
      Koc    :  6.379  L/kg (MCI method)
      Log Koc:  0.805       (MCI method)
      Koc    :  6.395  L/kg (Kow method)
      Log Koc:  0.806       (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 = 0.500 (BCF = 3.162 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -1.6398 days (HL = 0.02292 days)
   Log BCF Arnot-Gobas method (upper trophic) = -0.031 (BCF = 0.9308)
   Log BAF Arnot-Gobas method (upper trophic) = -0.031 (BAF = 0.9308)
       log Kow used: -0.13 (estimated)
 
 Volatilization from Water:
    Henry LC:  2.84E-008 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River: 2.053E+004  hours   (855.3 days)
    Half-Life from Model Lake :  2.24E+005  hours   (9334 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       0.402           9.52         1000       
   Water     36              360          1000       
   Soil      63.5            720          1000       
   Sediment  0.0755          3.24e+003    0          
     Persistence Time: 501 hr