Decachlorobiphenyl
c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)c2c(c(c(c(c2Cl)Cl)Cl)Cl)Cl
InChI=1S/C12Cl10/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16
ONXPZLFXDMAPRO-UHFFFAOYSA-N
CSID:15484, http://www.chemspider.com/Chemical-Structure.15484.html (accessed 10:16, Mar 28, 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) = 10.20 Log Kow (Exper. database match) = 8.27 Exper. Ref: DeBruijn,J et al. (1989) Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 471.68 (Adapted Stein & Brown method) Melting Pt (deg C): 199.37 (Mean or Weighted MP) VP(mm Hg,25 deg C): 1.02E-010 (Modified Grain method) MP (exp database): 305.8 deg C VP (exp database): 1.06E-07 mm Hg at 25 deg C Subcooled liquid VP: 6.35E-005 mm Hg (25 deg C, exp database VP ) Water Solubility Estimate from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 6.324e-005 log Kow used: 8.27 (expkow database) no-melting pt equation used Water Sol (Exper. database match) = 7.43e-006 mg/L (25 deg C) Exper. Ref: YALKOWSKY,SH & DANNENFELSER,RM (1992) Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 3.8862e-006 mg/L Wat Sol (Exper. database match) = 0.00 Exper. Ref: YALKOWSKY,SH & DANNENFELSER,RM (1992) ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 2.06E-005 atm-m3/mole Group Method: 8.48E-005 atm-m3/mole Exper Database: 9.40E-03 atm-m3/mole Henrys LC [VP/WSol estimate using EPI values]: 1.058E-006 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 8.27 (exp database) Log Kaw used: -0.415 (exp database) Log Koa (KOAWIN v1.10 estimate): 8.685 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : -1.3141 Biowin2 (Non-Linear Model) : 0.0000 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 0.0312 (recalcitrant) Biowin4 (Primary Survey Model) : 1.4749 (recalcitrant) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : -0.7097 Biowin6 (MITI Non-Linear Model): 0.0000 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): -3.1866 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): 0.00847 Pa (6.35E-005 mm Hg) Log Koa (Koawin est ): 8.685 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 0.000354 Octanol/air (Koa) model: 0.000119 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.0126 Mackay model : 0.0276 Octanol/air (Koa) model: 0.00942 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 0.0182 E-12 cm3/molecule-sec Half-Life = 588.560 Days (12-hr day; 1.5E6 OH/cm3) Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 0.0201 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 9.94E+005 Log Koc: 5.997 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 = 3.690 (BCF = 4899) log Kow used: 8.27 (expkow database) Volatilization from Water: Henry LC: 0.0094 atm-m3/mole (Henry experimental database) Half-Life from Model River: 2.418 hours Half-Life from Model Lake : 213.6 hours (8.901 days) Removal In Wastewater Treatment: Total removal: 94.03 percent Total biodegradation: 0.78 percent Total sludge adsorption: 93.21 percent Total to Air: 0.04 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: Mass Amount Half-Life Emissions (percent) (hr) (kg/hr) Air 0.0606 1.41e+004 1000 Water 0.619 4.32e+003 1000 Soil 50.2 8.64e+003 1000 Sediment 49.1 3.89e+004 0 Persistence Time: 1.39e+004 hr
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