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Boiling Point:
Vapour Pressure:
Enthalpy the Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H link acceptors: 7
#H shortcut donors: 0
#Freely Rotating Bonds: 2
#Rule the 5 Violations:

ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar surface Area: 112 Å2
Surface Tension:
Molar Volume:

Predicted data is generated using the US environmental Protection Agency’s EPISuite™

log in Octanol-Water Partition Coef (SRC): log Kow (KOWWIN v1.67 estimate) = -4.48 boil Pt, melting Pt, Vapor pressure Estimations (MPBPWIN v1.42): boiling Pt (deg C): 454.38 (Adapted Stein & Brown method) melt Pt (deg C): 171.49 (Mean or weighted MP) VP(mm Hg,25 deg C): 1.17E-008 (Modified serial method) Subcooled fluid VP: 3.82E-007 mm Hg (25 deg C, Mod-Grain method) Water Solubility estimate from log Kow (WSKOW v1.41): Water Solubility in ~ 25 deg C (mg/L): 1e+006 log in Kow used: -4.48 (estimated) no-melting pt equation offered Water Sol estimate from Fragments: Wat solar (v1.01 est) = 1e+006 mg/L ECOSAR class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law constant (25 deg C) : Bond an approach : Incomplete group Method: Incomplete Henrys LC : 2.816E-015 atm-m3/mole log Octanol-Air Partition Coefficient (25 deg C) : can Not estimate (can no calculate HenryLC) Probability of rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.6605 Biowin2 (Non-Linear Model) : 0.6014 skilled Survey Biodegradation Results: Biowin3 (Ultimate survey Model): 2.7950 (weeks ) Biowin4 (Primary inspection Model) : 3.5839 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI direct Model) : 0.1680 Biowin6 (MITI Non-Linear Model): 0.0598 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic straight Model): 0.8361 ready Biodegradability Prediction: NOHydrocarbon Biodegradation (BioHCwin v1.01): structure incompatible with current estimation method! Sorption come aerosols (25 Dec C): Vapor pressure (liquid/subcooled): 5.09E-005 Pa (3.82E-007 mm Hg) log Koa (): not accessible Kp (particle/gas partition coef. (m3/ug)): Mackay design : 0.0589 Octanol/air (Koa) model: not available fraction sorbed come airborne particulates (phi): Junge-Pankow design : 0.68 Mackay model : 0.825 Octanol/air (Koa) model: not available Atmospheric Oxidation (25 deg C) : Hydroxyl Radicals Reaction: in its entirety OH Rate consistent = 0.0000 E-12 cm3/molecule-sec Half-Life = ------- Ozone Reaction: No Ozone Reaction Estimation fraction sorbed come airborne particulates (phi): 0.753 (Junge,Mackay) Note: the sorbed portion may it is in resistant to atmospheric oxidation soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 393.3 log Koc: 2.595 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) : rate constants have the right to NOT be estimated for this structure! Bioaccumulation approximates from log Kow (BCFWIN v2.17): log BCF from regression-based an approach = 0.500 (BCF = 3.162) log Kow used: -4.48 (estimated) Volatilization indigenous Water: Henry LC: 2.82E-015 atm-m3/mole (calculated from VP/WS) Half-Life from design River: 2.812E+011 hours (1.172E+010 days) Half-Life from model Lake : 3.068E+012 hours (1.278E+011 days) removed In Wastewater Treatment: total removal: 1.85 percent full biodegradation: 0.09 percent total sludge adsorption: 1.75 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) waiting 2.48e-007 1e+005 1000 Water 39 360 1000 floor 60.9 720 1000 Sediment 0.0713 3.24e+003 0 Persistence Time: 579 hr

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