Try beta.chemspider
Oxybis(2,1-ethanediyloxy-2,1-ethanediyl) bisacrylate
C=CC(=O)OCCOCCOCCOCCOC(=O)C=C
InChI=1S/C14H22O7/c1-3-13(15)20-11-9-18-7-5-17-6-8-19-10-12-21-14(16)4-2/h3-4H,1-2,5-12H2
HCLJOFJIQIJXHS-UHFFFAOYSA-N
CSID:26793, http://www.chemspider.com/Chemical-Structure.26793.html (accessed 17:50, May 23, 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) = 0.29 Log Kow (Exper. database match) = 1.26 Exper. Ref: Sangster (1994) Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 334.40 (Adapted Stein & Brown method) Melting Pt (deg C): 7.11 (Mean or Weighted MP) VP(mm Hg,25 deg C): 0.000308 (Modified Grain method) Water Solubility Estimate from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 998.8 log Kow used: 1.26 (expkow database) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 52707 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Acrylates Surfactants-nonionic Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 5.78E-013 atm-m3/mole Group Method: 9.09E-017 atm-m3/mole Henrys LC [VP/WSol estimate using EPI values]: 1.227E-007 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 1.26 (exp database) Log Kaw used: -10.627 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 11.887 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : -0.0901 Biowin2 (Non-Linear Model) : 0.0319 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 2.7855 (weeks ) Biowin4 (Primary Survey Model) : 3.8403 (days ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.9371 Biowin6 (MITI Non-Linear Model): 0.8782 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.1748 Ready Biodegradability Prediction: YES Hydrocarbon Biodegradation (BioHCwin v1.01): Structure incompatible with current estimation method! Sorption to aerosols (25 Dec C)[AEROWIN v1.00]: Vapor pressure (liquid/subcooled): 0.0411 Pa (0.000308 mm Hg) Log Koa (Koawin est ): 11.887 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 7.31E-005 Octanol/air (Koa) model: 0.189 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.00263 Mackay model : 0.00581 Octanol/air (Koa) model: 0.938 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 64.1330 E-12 cm3/molecule-sec Half-Life = 0.167 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 2.001 Hrs Ozone Reaction: OVERALL Ozone Rate Constant = 0.350000 E-17 cm3/molecule-sec Half-Life = 3.274 Days (at 7E11 mol/cm3) Half-Life = 78.583 Hrs Fraction sorbed to airborne particulates (phi): 0.00422 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 10 Log Koc: 1.000 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v1.67]: Total Kb for pH > 8 at 25 deg C : 1.063E-001 L/mol-sec Kb Half-Life at pH 8: 75.466 days Kb Half-Life at pH 7: 2.066 years Bioaccumulation Estimates from Log Kow (BCFWIN v2.17): Log BCF from regression-based method = 0.270 (BCF = 1.863) log Kow used: 1.26 (expkow database) Volatilization from Water: Henry LC: 9.09E-017 atm-m3/mole (estimated by Group SAR Method) Half-Life from Model River: 1.12E+013 hours (4.666E+011 days) Half-Life from Model Lake : 1.222E+014 hours (5.091E+012 days) Removal In Wastewater Treatment: Total removal: 1.92 percent Total biodegradation: 0.09 percent Total sludge adsorption: 1.83 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 1.98e-009 3.81 1000 Water 32.1 360 1000 Soil 67.9 720 1000 Sediment 0.0687 3.24e+003 0 Persistence Time: 629 hr
Click to predict properties on the Chemicalize site
Advertisement
Spotlight