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2,2-Bis[(methacryloyloxy)methyl]pentyl methacrylate
CCCC(COC(=O)C(=C)C)(COC(=O)C(=C)C)COC(=O)C(=C)C
InChI=1S/C19H28O6/c1-8-9-19(10-23-16(20)13(2)3,11-24-17(21)14(4)5)12-25-18(22)15(6)7/h2,4,6,8-12H2,1,3,5,7H3
ZZYZXHWVEYEDLH-UHFFFAOYSA-N
CSID:15261263, http://www.chemspider.com/Chemical-Structure.15261263.html (accessed 12:35, Jun 10, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Predicted data is generated using the US Environmental Protection Agency�s EPISuite
Log Octanol-Water Partition Coef (SRC): Log Kow (KOWWIN v1.67 estimate) = 5.00 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 360.87 (Adapted Stein & Brown method) Melting Pt (deg C): 1.99 (Mean or Weighted MP) VP(mm Hg,25 deg C): 7.28E-005 (Modified Grain method) Water Solubility Estimate from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 0.3243 log Kow used: 5.00 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 2.7897 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Methacrylates Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 3.07E-009 atm-m3/mole Group Method: 2.34E-009 atm-m3/mole Henrys LC [VP/WSol estimate using EPI values]: 1.041E-004 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 5.00 (KowWin est) Log Kaw used: -6.901 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 11.901 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.9184 Biowin2 (Non-Linear Model) : 0.9998 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 2.6289 (weeks-months) Biowin4 (Primary Survey Model) : 3.8727 (days ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 1.0483 Biowin6 (MITI Non-Linear Model): 0.9231 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.3879 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): 0.00971 Pa (7.28E-005 mm Hg) Log Koa (Koawin est ): 11.901 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 0.000309 Octanol/air (Koa) model: 0.195 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.011 Mackay model : 0.0241 Octanol/air (Koa) model: 0.94 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 62.6215 E-12 cm3/molecule-sec Half-Life = 0.171 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 2.050 Hrs Ozone Reaction: OVERALL Ozone Rate Constant = 3.412500 E-17 cm3/molecule-sec Half-Life = 0.336 Days (at 7E11 mol/cm3) Half-Life = 8.060 Hrs Fraction sorbed to airborne particulates (phi): 0.0176 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 1.389E+004 Log Koc: 4.143 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v1.67]: Total Kb for pH > 8 at 25 deg C : 3.189E-003 L/mol-sec Kb Half-Life at pH 8: 6.888 years Kb Half-Life at pH 7: 68.876 years Bioaccumulation Estimates from Log Kow (BCFWIN v2.17): Log BCF from regression-based method = 3.147 (BCF = 1402) log Kow used: 5.00 (estimated) Volatilization from Water: Henry LC: 2.34E-009 atm-m3/mole (estimated by Group SAR Method) Half-Life from Model River: 4.697E+005 hours (1.957E+004 days) Half-Life from Model Lake : 5.124E+006 hours (2.135E+005 days) Removal In Wastewater Treatment: Total removal: 77.70 percent Total biodegradation: 0.68 percent Total sludge adsorption: 77.02 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) Air 0.0123 2.72 1000 Water 8.64 900 1000 Soil 71.6 1.8e+003 1000 Sediment 19.8 8.1e+003 0 Persistence Time: 2.07e+003 hr
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