2,2',3,3',5,5',6,6'-Octafluorobiphenyl
Fc2c(c1c(F)c(F)cc(F)c1F)c(F)c(F)cc2F CopyCopied
InChI=1S/C12H2F8/c13-3-1-4(14)10(18)7(9(3)17)8-11(19)5(15)2-6(16)12(8)20/h1-2H CopyCopied
QWCHHUZAAGRHDB-UHFFFAOYSA-N CopyCopied
Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts
1,1'-Biphenyl, 2,2',3,3',5,5',6,6'-octafluoro-
2,2',3,3',5,5',6,6'-octafluorobiphenyl [ACD/IUPAC Name]
223-418-7 [EINECS]
Biphenyl, 2,2',3,3',5,5',6,6'-octafluoro-
1,1'-Biphenyl, 2,2',3, 3',5,5',6,6'-octafluoro-
1,2,4,5-tetrafluoro-3-(2,3,5,6-tetrafluorophenyl)benzene
2,2',3,3',5,5',6, 6'-Octafluorobiphenyl
2,2',3,3',5,5',6,6'-octafluoro-1,1'-biphenyl
2,2′,3,3′,5,5′,6,6′-Octafluorobiphenyl
387-97-3 [RN]
3883-86-1 [RN]
4, 4'-Dihydrooctafluorobiphenyl
4,4'-Dihydrooctafluorobiphenyl
4-H, 4'-H-Octafluorobiphenyl
4H,4H'-Octafluorobiphenyl
4H,4'H-Octafluorobiphenyl
5-Fluoro-8-hydroxyquinoline
196630_ALDRICH [DBID]
MFCD00000312 [DBID]
NSC 96909 [DBID]
NSC96909 [DBID]
Data supplied by datasources and users.
Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.
Predicted data is generated using the US Environmental Protection Agency’s EPISuite™, for more information see their website.
Log Octanol-Water Partition Coef (SRC): Log Kow (KOWWIN v1.67 estimate) = 5.36 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 240.97 (Adapted Stein & Brown method) Melting Pt (deg C): 47.67 (Mean or Weighted MP) VP(mm Hg,25 deg C): 0.0112 (Modified Grain method) MP (exp database): 85 deg C Subcooled liquid VP: 0.0422 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): 0.3329 log Kow used: 5.36 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 6.2406 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 1.42E-003 atm-m3/mole Group Method: 1.69E+000 atm-m3/mole Henrys LC [VP/WSol estimate using EPI values]: 1.320E-002 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 5.36 (KowWin est) Log Kaw used: -1.236 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 6.596 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : -5.8743 Biowin2 (Non-Linear Model) : 0.0000 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): -0.7152 (recalcitrant) Biowin4 (Primary Survey Model) : 3.5253 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : -0.0194 Biowin6 (MITI Non-Linear Model): 0.0000 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.6452 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): 5.63 Pa (0.0422 mm Hg) Log Koa (Koawin est ): 6.596 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 5.33E-007 Octanol/air (Koa) model: 9.68E-007 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 1.93E-005 Mackay model : 4.27E-005 Octanol/air (Koa) model: 7.75E-005 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 0.2368 E-12 cm3/molecule-sec Half-Life = 45.176 Days (12-hr day; 1.5E6 OH/cm3) Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 3.1E-005 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 3.49E+005 Log Koc: 5.543 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 = 4.047 (BCF = 1.115e+004) log Kow used: 5.36 (estimated) Volatilization from Water: Henry LC: 1.69 atm-m3/mole (estimated by Group SAR Method) Half-Life from Model River: 1.763 hours Half-Life from Model Lake : 164 hours (6.834 days) Removal In Wastewater Treatment (recommended maximum 95%): Total removal: 99.88 percent Total biodegradation: 0.16 percent Total sludge adsorption: 54.24 percent Total to Air: 45.47 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: Mass Amount Half-Life Emissions (percent) (hr) (kg/hr) Air 6.61 1.08e+003 1000 Water 7.38 4.32e+003 1000 Soil 8.86 8.64e+003 1000 Sediment 77.1 3.89e+004 0 Persistence Time: 1.21e+003 hr
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