This page contains the EPI System Summary only.
For complete control of this information -
Download the free EPI SuiteTM v4.0 program : here
also you can go back to the Datasheet
CAS Number: 374-60-7
SMILES : C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)
F
CHEM :
MOL FOR: C10 F20
MOL WT : 500.08
------------------------------ EPI SUMMARY (v4.11) --------------------------
Henry LC (atm-m3/mole) : ------
Log Kow (octanol-water): ------
Boiling Point (deg C) : ------
Water Solubility (mg/L): ------
Physical Property Inputs:
Vapor Pressure (mm Hg) : ------
Melting Point (deg C) : ------
Log Octanol-Water Partition Coef (SRC):
Log Kow (KOWWIN v1.68 estimate) = 7.00
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
Boiling Pt (deg C): 122.69 (Adapted Stein & Brown method)
Melting Pt (deg C): -80.83 (Mean or Weighted MP)
VP(mm Hg,25 deg C): 16.8 (Mean VP of Antoine & Grain methods)
VP (Pa, 25 deg C) : 2.24E+003 (Mean VP of Antoine & Grain methods)
Water Solubility Estimate from Log Kow (WSKOW v1.42):
Water Solubility at 25 deg C (mg/L): 0.000137
log Kow used: 7.00 (estimated)
no-melting pt equation used
Water Sol Estimate from Fragments:
Wat Sol (v1.01 est) = 5.0008e-007 mg/L
ECOSAR Class Program (ECOSAR v1.11):
Class(es) found:
Neutral Organics
Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
Bond Method : 1.56E+006 atm-m3/mole (1.58E+011 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: 8.069E+004 atm-m3/mole (8.176E+009 Pa-m3/mole)
VP: 16.8 mm Hg (source: MPBPVP)
WS: 0.000137 mg/L (source: WSKOWWIN)
Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
Log Kow used: 7.00 (KowWin est)
Log Kaw used: 7.805 (HenryWin est)
Log Koa (KOAWIN v1.10 estimate): -0.805
Log Koa (experimental database): None
Probability of Rapid Biodegradation (BIOWIN v4.10):
Biowin1 (Linear Model) : -1.6663
Biowin2 (Non-Linear Model) : 0.0000
Expert Survey Biodegradation Results:
Biowin3 (Ultimate Survey Model): -0.3280 (recalcitrant)
Biowin4 (Primary Survey Model) : 1.4709 (recalcitrant)
MITI Biodegradation Probability:
Biowin5 (MITI Linear Model) : 0.1805
Biowin6 (MITI Non-Linear Model): 0.0000
Anaerobic Biodegradation Probability:
Biowin7 (Anaerobic Linear Model): -2.1720
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): 2.09E+003 Pa (15.7 mm Hg)
Log Koa (Koawin est ): -0.805
Kp (particle/gas partition coef. (m3/ug)):
Mackay model : 1.43E-009
Octanol/air (Koa) model: 3.85E-014
Fraction sorbed to airborne particulates (phi):
Junge-Pankow model : 5.18E-008
Mackay model : 1.15E-007
Octanol/air (Koa) model: 3.08E-012
Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
Hydroxyl Radicals Reaction:
OVERALL OH Rate Constant = 0.0000 E-12 cm3/molecule-sec
Half-Life = -------
Ozone Reaction:
No Ozone Reaction Estimation
Fraction sorbed to airborne particulates (phi):
8.32E-008 (Junge-Pankow, Mackay avg)
3.08E-012 (Koa method)
Note: the sorbed fraction may be resistant to atmospheric oxidation
Soil Adsorption Coefficient (KOCWIN v2.00):
Koc : 1.306E+007 L/kg (MCI method)
Log Koc: 7.116 (MCI method)
Koc : 1.188E+006 L/kg (Kow method)
Log Koc: 6.075 (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 = 4.284 (BCF = 1.923e+004 L/kg wet-wt)
Log Biotransformation Half-life (HL) = 1.9745 days (HL = 94.29 days)
Log BCF Arnot-Gobas method (upper trophic) = 3.792 (BCF = 6194)
Log BAF Arnot-Gobas method (upper trophic) = 6.442 (BAF = 2.769e+006)
log Kow used: 7.00 (estimated)
Volatilization from Water:
Henry LC: 1.56E+006 atm-m3/mole (estimated by Bond SAR Method)
Half-Life from Model River: 2.282 hours
Half-Life from Model Lake : 212.4 hours (8.85 days)
Removal In Wastewater Treatment (recommended maximum 95%):
Total removal: 100.00 percent
Total biodegradation: 0.17 percent
Total sludge adsorption: 59.74 percent
Total to Air: 40.08 percent
(using 10000 hr Bio P,A,S)
Level III Fugacity Model:
Mass Amount Half-Life Emissions
(percent) (hr) (kg/hr)
Air 1.06 1e+005 1000
Water 1.22 4.32e+003 1000
Soil 0.0108 8.64e+003 1000
Sediment 97.7 3.89e+004 0
Persistence Time: 6.35e+003 hr