Try beta.chemspider
(Chloromethyl)(2-chlorophenoxy)dimethylsilane
C[Si](C)(CCl)Oc1ccccc1Cl
InChI=1S/C9H12Cl2OSi/c1-13(2,7-10)12-9-6-4-3-5-8(9)11/h3-6H,7H2,1-2H3
SOGDRQNKMITNBY-UHFFFAOYSA-N
CSID:2038438, http://www.chemspider.com/Chemical-Structure.2038438.html (accessed 14:53, Aug 5, 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) = 4.75 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 269.90 (Adapted Stein & Brown method) Melting Pt (deg C): 45.42 (Mean or Weighted MP) VP(mm Hg,25 deg C): 0.00619 (Modified Grain method) Subcooled liquid VP: 0.00951 mm Hg (25 deg C, Mod-Grain method) Water Solubility Estimate from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 2.52 log Kow used: 4.75 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 27.585 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 1.56E-003 atm-m3/mole Group Method: Incomplete Henrys LC [VP/WSol estimate using EPI values]: 7.601E-004 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 4.75 (KowWin est) Log Kaw used: -1.195 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 5.945 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.3418 Biowin2 (Non-Linear Model) : 0.0148 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 2.2997 (weeks-months) Biowin4 (Primary Survey Model) : 3.2425 (weeks ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.1028 Biowin6 (MITI Non-Linear Model): 0.0152 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): -0.0957 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): 1.27 Pa (0.00951 mm Hg) Log Koa (Koawin est ): 5.945 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 2.37E-006 Octanol/air (Koa) model: 2.16E-007 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 8.55E-005 Mackay model : 0.000189 Octanol/air (Koa) model: 1.73E-005 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 6.9682 E-12 cm3/molecule-sec Half-Life = 1.535 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 18.420 Hrs Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 0.000137 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 6921 Log Koc: 3.840 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v1.67]: Rate constants can NOT be estimated for this structure! Bioaccumulation Estimates from Log Kow (BCFWIN v2.17): Log BCF from regression-based method = 2.955 (BCF = 902) log Kow used: 4.75 (estimated) Volatilization from Water: Henry LC: 0.00156 atm-m3/mole (estimated by Bond SAR Method) Half-Life from Model River: 2.14 hours Half-Life from Model Lake : 151.9 hours (6.331 days) Removal In Wastewater Treatment: Total removal: 75.39 percent Total biodegradation: 0.50 percent Total sludge adsorption: 61.60 percent Total to Air: 13.28 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: Mass Amount Half-Life Emissions (percent) (hr) (kg/hr) Air 1.7 36.8 1000 Water 7.97 900 1000 Soil 79.8 1.8e+003 1000 Sediment 10.5 8.1e+003 0 Persistence Time: 1.05e+003 hr
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