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

ACD/LogP:
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
Polarizability:
Surface Tension:
Molar Volume:

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

log in Octanol-Water Partition Coef (SRC): log in Kow (KOWWIN v1.67 estimate) = 0.23 boil Pt, melt Pt, Vapor press Estimations (MPBPWIN v1.42): cook Pt (deg C): 482.98 (Adapted Stein & Brown method) melt Pt (deg C): 188.60 (Mean or weight MP) VP(mm Hg,25 deg C): 4.24E-009 (Modified grain method) Subcooled fluid VP: 2.19E-007 mm Hg (25 deg C, Mod-Grain method) Water Solubility calculation from log Kow (WSKOW v1.41): Water Solubility in ~ 25 deg C (mg/L): 8.551e+004 log Kow used: 0.23 (estimated) no-melting pt equation offered Water Sol estimate from Fragments: Wat solar (v1.01 est) = 84968 mg/L ECOSAR class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law consistent (25 deg C) : Bond an approach : 2.45E-002 atm-m3/mole team Method: Incomplete Henrys LC : 3.123E-015 atm-m3/mole log Octanol-Air Partition Coefficient (25 deg C) : log Kow used: 0.23 (KowWin est) log in Kaw used: 0.001 (HenryWin est) log Koa (KOAWIN v1.10 estimate): 0.229 log Koa (experimental database): no one Probability of rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.7248 Biowin2 (Non-Linear Model) : 0.9112 experienced Survey Biodegradation Results: Biowin3 (Ultimate survey Model): 3.0934 (weeks ) Biowin4 (Primary inspection Model) : 3.7787 (days ) MITI Biodegradation Probability: Biowin5 (MITI straight Model) : 0.5697 Biowin6 (MITI Non-Linear Model): 0.7584 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic straight Model): 0.8361 all set Biodegradability Prediction: YESHydrocarbon Biodegradation (BioHCwin v1.01): structure incompatible with present estimation method! Sorption come aerosols (25 Dec C): Vapor press (liquid/subcooled): 2.92E-005 Pa (2.19E-007 mm Hg) log in Koa (Koawin est ): 0.229 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 0.103 Octanol/air (Koa) model: 4.16E-013 portion sorbed come airborne particulates (phi): Junge-Pankow model : 0.788 Mackay model : 0.892 Octanol/air (Koa) model: 3.33E-011 Atmospheric Oxidation (25 deg C) : Hydroxyl Radicals Reaction: in its entirety OH Rate constant = 0.0000 E-12 cm3/molecule-sec Half-Life = ------- Ozone Reaction: No Ozone Reaction Estimation fraction sorbed to airborne particulates (phi): 0.84 (Junge,Mackay) Note: the sorbed portion may it is in resistant to atmospheric oxidation soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 14.3 log in Koc: 1.155 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) : rate constants have the right to NOT be estimated for this structure! Bioaccumulation estimates from log Kow (BCFWIN v2.17): log in BCF native regression-based an approach = 0.500 (BCF = 3.162) log Kow used: 0.23 (estimated) Volatilization indigenous Water: Henry LC: 0.0245 atm-m3/mole (estimated by link SAR Method) Half-Life from model River: 0.7226 hours (43.35 min) Half-Life from model Lake : 65.9 hrs (2.746 days) removal In Wastewater Treatment: total removal: 90.51 percent full biodegradation: 0.02 percent total sludge adsorption: 0.40 percent full to Air: 90.09 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: massive Amount Half-Life Emissions (percent) (hr) (kg/hr) wait 40.2 1e+005 1000 Water 54.1 360 1000 floor 5.63 720 1000 Sediment 0.101 3.24e+003 0 Persistence Time: 177 hr

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