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Boiling Point:
Vapour Pressure:
Enthalpy that Vaporization:
Flash Point:
Index that Refraction:
Molar Refractivity:
#H shortcut acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule that 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 ar Area: 0 Å2
Surface Tension:
Molar Volume:

Predicted data is produced using the US eco-friendly Protection Agency’s EPISuite™

log in Octanol-Water Partition Coef (SRC): log Kow (KOWWIN v1.67 estimate) = 0.32 cook Pt, melting Pt, Vapor push Estimations (MPBPWIN v1.42): boil Pt (deg C): 507.12 (Adapted Stein & Brown method) melting Pt (deg C): 196.36 (Mean or weight MP) VP(mm Hg,25 deg C): 9.04E-010 (Modified grain method) Subcooled liquid VP: 5.75E-008 mm Hg (25 deg C, Mod-Grain method) Water Solubility estimate from log in Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 6.851e+004 log Kow used: 0.32 (estimated) no-melting pt equation used Water Sol estimate from Fragments: Wat solar (v1.01 est) = 50047 mg/L ECOSAR course Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law continuous (25 deg C) : Bond an approach : Incomplete group Method: Incomplete Henrys LC : 1.458E-015 atm-m3/mole log in Octanol-Air Partition Coefficient (25 deg C) : deserve to Not calculation (can not calculate HenryLC) Probability of quick Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.7076 Biowin2 (Non-Linear Model) : 0.8601 expert Survey Biodegradation Results: Biowin3 (Ultimate survey Model): 3.0136 (weeks ) Biowin4 (Primary survey Model) : 3.7266 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI direct Model) : 0.5144 Biowin6 (MITI Non-Linear Model): 0.0000 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic direct Model): 0.8361 ready Biodegradability Prediction: YESHydrocarbon Biodegradation (BioHCwin v1.01): framework incompatible with present estimation method! Sorption to aerosols (25 Dec C): Vapor press (liquid/subcooled): 7.67E-006 Pa (5.75E-008 mm Hg) log Koa (): not available Kp (particle/gas partition coef. (m3/ug)): Mackay version : 0.391 Octanol/air (Koa) model: not available fraction sorbed to airborne particulates (phi): Junge-Pankow version : 0.934 Mackay design : 0.969 Octanol/air (Koa) model: not accessible Atmospheric Oxidation (25 deg C) : Hydroxyl Radicals Reaction: as whole OH Rate constant = 0.0000 E-12 cm3/molecule-sec Half-Life = ------- Ozone Reaction: No Ozone Reaction Estimation portion sorbed to airborne particulates (phi): 0.951 (Junge,Mackay) Note: the sorbed portion may it is in resistant to atmospheric oxidation floor Adsorption Coefficient (PCKOCWIN v1.66): Koc : 35.04 log in Koc: 1.545 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) : rate constants deserve to NOT be approximated for this structure! Bioaccumulation approximates from log in Kow (BCFWIN v2.17): log BCF native regression-based an approach = 0.500 (BCF = 3.162) log Kow used: 0.32 (estimated) Volatilization native Water: Henry LC: 1.46E-015 atm-m3/mole (calculated indigenous VP/WS) Half-Life from version River: 3.68E+011 hours (1.533E+010 days) Half-Life from version Lake : 4.014E+012 hrs (1.673E+011 days) removed In Wastewater Treatment: full removal: 1.86 percent full biodegradation: 0.09 percent full 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) wait 7.16e-007 1e+005 1000 Water 37.9 360 1000 soil 62 720 1000 Sediment 0.0707 3.24e+003 0 Persistence Time: 586 hr

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