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1,1,1-Trimethyl-N-propylsilanamine
CCCN[Si](C)(C)C
InChI=1S/C6H17NSi/c1-5-6-7-8(2,3)4/h7H,5-6H2,1-4H3
IQLUAGKMPYRZCF-UHFFFAOYSA-N
CSID:461187, http://www.chemspider.com/Chemical-Structure.461187.html (accessed 14:35, May 17, 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) = 2.20 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 116.29 (Adapted Stein & Brown method) Melting Pt (deg C): -50.51 (Mean or Weighted MP) VP(mm Hg,25 deg C): 18.4 (Mean VP of Antoine & Grain methods) Water Solubility Estimate from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 1190 log Kow used: 2.20 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 574.18 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Silamines Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 6.70E-005 atm-m3/mole Group Method: Incomplete Henrys LC [VP/WSol estimate using EPI values]: 2.671E-003 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 2.20 (KowWin est) Log Kaw used: -2.562 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 4.762 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.6850 Biowin2 (Non-Linear Model) : 0.7585 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 2.9090 (weeks ) Biowin4 (Primary Survey Model) : 3.6583 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.4220 Biowin6 (MITI Non-Linear Model): 0.4187 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.5698 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): 2.31E+003 Pa (17.3 mm Hg) Log Koa (Koawin est ): 4.762 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 1.3E-009 Octanol/air (Koa) model: 1.42E-008 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 4.7E-008 Mackay model : 1.04E-007 Octanol/air (Koa) model: 1.14E-006 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 12.4489 E-12 cm3/molecule-sec Half-Life = 0.859 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 10.310 Hrs Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 7.55E-008 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 246.9 Log Koc: 2.393 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 = 0.998 (BCF = 9.944) log Kow used: 2.20 (estimated) Volatilization from Water: Henry LC: 6.7E-005 atm-m3/mole (estimated by Bond SAR Method) Half-Life from Model River: 11.18 hours Half-Life from Model Lake : 218.1 hours (9.086 days) Removal In Wastewater Treatment: Total removal: 5.81 percent Total biodegradation: 0.09 percent Total sludge adsorption: 2.32 percent Total to Air: 3.40 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: Mass Amount Half-Life Emissions (percent) (hr) (kg/hr) Air 2.6 20.6 1000 Water 28.3 360 1000 Soil 69 720 1000 Sediment 0.127 3.24e+003 0 Persistence Time: 381 hr
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