Try beta.chemspider
2-(Diphenylphosphino)-1,1'-bi(cyclopentyl)-1,1',2,2',3,3',4,4',5,5'-decayl
c1ccc(cc1)P(c2ccccc2)[C]3[CH][CH][CH][C]3[C]4[CH][CH][CH][CH]4
InChI=1S/C22H17P/c1-3-12-19(13-4-1)23(20-14-5-2-6-15-20)22-17-9-16-21(22)18-10-7-8-11-18/h1-17H
BMYSMZYWSRSVMH-UHFFFAOYSA-N
CSID:8344754, http://www.chemspider.com/Chemical-Structure.8344754.html (accessed 00:16, Jul 6, 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
No predicted properties have been calculated for this compound.
Predicted data is generated using the US Environmental Protection Agency�s EPISuite
Log Octanol-Water Partition Coef (SRC): Log Kow (KOWWIN v1.67 estimate) = 7.78 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 411.41 (Adapted Stein & Brown method) Melting Pt (deg C): 137.57 (Mean or Weighted MP) VP(mm Hg,25 deg C): 3.22E-007 (Modified Grain method) Subcooled liquid VP: 4.38E-006 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): 0.00206 log Kow used: 7.78 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 0.0026164 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 2.20E-006 atm-m3/mole Group Method: Incomplete Henrys LC [VP/WSol estimate using EPI values]: 6.631E-005 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 7.78 (KowWin est) Log Kaw used: -4.046 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 11.826 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.8502 Biowin2 (Non-Linear Model) : 0.8837 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 2.5307 (weeks-months) Biowin4 (Primary Survey Model) : 3.3923 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.0105 Biowin6 (MITI Non-Linear Model): 0.0132 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): -0.4036 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): 0.000584 Pa (4.38E-006 mm Hg) Log Koa (Koawin est ): 11.826 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 0.00514 Octanol/air (Koa) model: 0.164 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.157 Mackay model : 0.291 Octanol/air (Koa) model: 0.929 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 16.7295 E-12 cm3/molecule-sec Half-Life = 0.639 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 7.672 Hrs Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 0.224 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 5.039E+006 Log Koc: 6.702 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 = 3.743 (BCF = 5532) log Kow used: 7.78 (estimated) Volatilization from Water: Henry LC: 2.2E-006 atm-m3/mole (estimated by Bond SAR Method) Half-Life from Model River: 479.7 hours (19.99 days) Half-Life from Model Lake : 5384 hours (224.3 days) Removal In Wastewater Treatment: Total removal: 94.00 percent Total biodegradation: 0.78 percent Total sludge adsorption: 93.23 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 0.168 15.3 1000 Water 1.9 900 1000 Soil 29.5 1.8e+003 1000 Sediment 68.4 8.1e+003 0 Persistence Time: 3.2e+003 hr
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