Try beta.chemspider
1,4,4,7,8,9,10,10-Octachlorotricyclo[5.2.1.0~2,6~]dec-8-ene
C1C2C(CC1(Cl)Cl)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl
InChI=1S/C10H6Cl8/c11-5-6(12)9(16)4-2-7(13,14)1-3(4)8(5,15)10(9,17)18/h3-4H,1-2H2
JBZJEPYXXVKOKF-UHFFFAOYSA-N
CSID:20427, http://www.chemspider.com/Chemical-Structure.20427.html (accessed 05:09, Jun 1, 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) = 7.00 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 335.35 (Adapted Stein & Brown method) Melting Pt (deg C): 131.25 (Mean or Weighted MP) VP(mm Hg,25 deg C): 2.52E-005 (Modified Grain method) Subcooled liquid VP: 0.000293 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): 0.002798 log Kow used: 7.00 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 0.0018167 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Vinyl/Allyl Halides Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 7.03E-005 atm-m3/mole Group Method: Incomplete Henrys LC [VP/WSol estimate using EPI values]: 4.856E-003 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 7.00 (KowWin est) Log Kaw used: -2.542 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 9.542 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : -1.0744 Biowin2 (Non-Linear Model) : 0.0000 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 0.0597 (recalcitrant) Biowin4 (Primary Survey Model) : 1.8379 (months ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : -0.1634 Biowin6 (MITI Non-Linear Model): 0.0000 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): -0.7792 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): 0.0391 Pa (0.000293 mm Hg) Log Koa (Koawin est ): 9.542 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 7.68E-005 Octanol/air (Koa) model: 0.000855 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.00277 Mackay model : 0.00611 Octanol/air (Koa) model: 0.064 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 6.4588 E-12 cm3/molecule-sec Half-Life = 1.656 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 19.873 Hrs Ozone Reaction: OVERALL Ozone Rate Constant = 0.003579 E-17 cm3/molecule-sec Half-Life = 320.239 Days (at 7E11 mol/cm3) Fraction sorbed to airborne particulates (phi): 0.00444 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 7.534E+004 Log Koc: 4.877 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 = 4.809 (BCF = 6.446e+004) log Kow used: 7.00 (estimated) Volatilization from Water: Henry LC: 7.03E-005 atm-m3/mole (estimated by Bond SAR Method) Half-Life from Model River: 18.92 hours Half-Life from Model Lake : 376.2 hours (15.67 days) Removal In Wastewater Treatment: Total removal: 93.85 percent Total biodegradation: 0.78 percent Total sludge adsorption: 93.06 percent Total to Air: 0.01 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: Mass Amount Half-Life Emissions (percent) (hr) (kg/hr) Air 0.117 39.5 1000 Water 0.846 4.32e+003 1000 Soil 40.2 8.64e+003 1000 Sediment 58.8 3.89e+004 0 Persistence Time: 1.04e+004 hr
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