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Density: 1.5±0.1 g/cm3
Boiling Point: 95.6±8.0 °C in ~ 760 mmHg
Vapour Pressure: 51.6±0.2 mmHg in ~ 25°C
Enthalpy the Vaporization: 32.1±3.0 kJ/mol
Flash Point: 17.5±8.5 °C
Index the Refraction: 1.467
Molar Refractivity: 28.5±0.3 cm3
#H bond acceptors: 0
#H link donors: 0
#Freely Rotating Bonds: 0
#Rule that 5 Violations: 0

ACD/LogP: 2.11
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 22.38
ACD/KOC (pH 5.5): 322.01
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 22.38
ACD/KOC (pH 7.4): 322.01
Polar surface Area: 0 Å2
Polarizability: 11.3±0.5 10-24cm3
Surface Tension: 28.5±3.0 dyne/cm
Molar Volume: 102.7±3.0 cm3

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

log in Octanol-Water Partition Coef (SRC): log Kow (KOWWIN v1.67 estimate) = 3.01 cook Pt, melting Pt, Vapor press Estimations (MPBPWIN v1.42): cook Pt (deg C): 92.06 (Adapted Stein & Brown method) melting Pt (deg C): -58.68 (Mean or weight MP) VP(mm Hg,25 deg C): 46.4 (Mean VP that Antoine & grain methods) BP (exp database): 95 deg C Water Solubility estimate from log in Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 190.5 log in Kow used: 3.01 (estimated) no-melting pt equation used Water Sol calculation from Fragments: Wat sol (v1.01 est) = 787.27 mg/L ECOSAR class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law constant (25 deg C) : Bond method : 5.27E-003 atm-m3/mole team Method: Incomplete Henrys LC : 5.046E-002 atm-m3/mole log Octanol-Air Partition Coefficient (25 deg C) : log Kow used: 3.01 (KowWin est) log in Kaw used: -0.667 (HenryWin est) log Koa (KOAWIN v1.10 estimate): 3.677 log in Koa (experimental database): no one Probability of fast Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.3311 Biowin2 (Non-Linear Model) : 0.0007 professional Survey Biodegradation Results: Biowin3 (Ultimate inspection Model): 2.4949 (weeks-months) Biowin4 (Primary inspection Model) : 3.4019 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI straight Model) : 0.4100 Biowin6 (MITI Non-Linear Model): 0.0586 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic linear Model): 0.6871 ready Biodegradability Prediction: NOHydrocarbon Biodegradation (BioHCwin v1.01): structure incompatible with existing estimation method! Sorption to aerosols (25 Dec C): Vapor press (liquid/subcooled): 5.91E+003 Pa (44.3 mm Hg) log Koa (Koawin est ): 3.677 Kp (particle/gas partition coef. (m3/ug)): Mackay version : 5.08E-010 Octanol/air (Koa) model: 1.17E-009 portion sorbed come airborne particulates (phi): Junge-Pankow design : 1.83E-008 Mackay design : 4.06E-008 Octanol/air (Koa) model: 9.33E-008 Atmospheric Oxidation (25 deg C) : Hydroxyl Radicals Reaction: as whole OH Rate consistent = 0.0680 E-12 cm3/molecule-sec Half-Life = 157.294 work (12-hr day; 1.5E6 OH/cm3) Ozone Reaction: No Ozone Reaction Estimation fraction sorbed to airborne particulates (phi): 2.95E-008 (Junge,Mackay) Note: the sorbed fraction may it is in resistant come atmospheric oxidation soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 48.64 log in Koc: 1.687 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) : full Kb because that pH > 8 at 25 deg C : 1.061E-005 L/mol-sec Kb Half-Life at pH 8: 2069.627 years Kb Half-Life at pH 7: 2.070E+004 year Bioaccumulation approximates from log Kow (BCFWIN v2.17): log in BCF indigenous regression-based technique = 1.614 (BCF = 41.16) log Kow used: 3.01 (estimated) Volatilization indigenous Water: Henry LC: 0.00527 atm-m3/mole (estimated by link SAR Method) Half-Life from model River: 1.42 hrs Half-Life from design Lake : 120.7 hrs (5.029 days) removal In Wastewater Treatment: total removal: 68.49 percent total biodegradation: 0.06 percent complete sludge adsorption: 3.59 percent complete to Air: 64.85 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: massive Amount Half-Life Emissions (percent) (hr) (kg/hr) wait 26.5 3.78e+003 1000 Water 27.4 900 1000 soil 45.5 1.8e+003 1000 Sediment 0.637 8.1e+003 0 Persistence Time: 297 hr

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