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- Double-bond stereo
(5E)-5-Decen-1-ol
CCCC/C=C/CCCCO
InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h5-6,11H,2-4,7-10H2,1H3/b6-5+
WYPQHXVMNVEVEB-AATRIKPKSA-N
CSID:4446413, http://www.chemspider.com/Chemical-Structure.4446413.html (accessed 18:22, May 16, 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) = 3.57 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 244.14 (Adapted Stein & Brown method) Melting Pt (deg C): 6.97 (Mean or Weighted MP) VP(mm Hg,25 deg C): 0.00474 (Mean VP of Antoine & Grain methods) Water Solubility Estimate from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 204.8 log Kow used: 3.57 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 171.68 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 4.81E-005 atm-m3/mole Group Method: 2.03E-005 atm-m3/mole Henrys LC [VP/WSol estimate using EPI values]: 4.759E-006 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 3.57 (KowWin est) Log Kaw used: -2.706 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 6.276 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.9403 Biowin2 (Non-Linear Model) : 0.9770 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 3.3121 (days-weeks ) Biowin4 (Primary Survey Model) : 4.0208 (days ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.7671 Biowin6 (MITI Non-Linear Model): 0.8910 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.6064 Ready Biodegradability Prediction: YES Hydrocarbon Biodegradation (BioHCwin v1.01): Structure incompatible with current estimation method! Sorption to aerosols (25 Dec C)[AEROWIN v1.00]: Vapor pressure (liquid/subcooled): 0.605 Pa (0.00454 mm Hg) Log Koa (Koawin est ): 6.276 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 4.96E-006 Octanol/air (Koa) model: 4.63E-007 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.000179 Mackay model : 0.000396 Octanol/air (Koa) model: 3.71E-005 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 68.4138 E-12 cm3/molecule-sec [Cis-isomer] OVERALL OH Rate Constant = 76.0138 E-12 cm3/molecule-sec [Trans-isomer] Half-Life = 1.876 Hrs (12-hr day; 1.5E6 OH/cm3) [Cis-isomer] Half-Life = 1.689 Hrs (12-hr day; 1.5E6 OH/cm3) [Trans-isomer] Ozone Reaction: OVERALL Ozone Rate Constant = 13.000000 E-17 cm3/molecule-sec [Cis-] OVERALL Ozone Rate Constant = 20.000000 E-17 cm3/molecule-sec [Trans-] Half-Life = 2.116 Hrs (at 7E11 mol/cm3) [Cis-isomer] Half-Life = 1.375 Hrs (at 7E11 mol/cm3) [Trans-isomer] Reaction With Nitrate Radicals May Be Important! Fraction sorbed to airborne particulates (phi): 0.000288 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 96.17 Log Koc: 1.983 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 = 2.051 (BCF = 112.4) log Kow used: 3.57 (estimated) Volatilization from Water: Henry LC: 4.81E-005 atm-m3/mole (estimated by Bond SAR Method) Half-Life from Model River: 16.49 hours Half-Life from Model Lake : 284.7 hours (11.86 days) Removal In Wastewater Treatment: Total removal: 16.72 percent Total biodegradation: 0.19 percent Total sludge adsorption: 14.36 percent Total to Air: 2.17 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: Mass Amount Half-Life Emissions (percent) (hr) (kg/hr) Air 0.256 1.35 1000 Water 25.9 208 1000 Soil 73 416 1000 Sediment 0.891 1.87e+003 0 Persistence Time: 272 hr
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