- Double-bond stereo
N'-[(1Z)-1-(2-Chlorophenyl)ethylidene]-2-hydroxyacetohydrazide
C/C(=N/NC(=O)CO)/c1ccccc1Cl
InChI=1S/C10H11ClN2O2/c1-7(12-13-10(15)6-14)8-4-2-3-5-9(8)11/h2-5,14H,6H2,1H3,(H,13,15)/b12-7-
HYGXARKQZYBDIW-GHXNOFRVSA-N
CSID:4677695, http://www.chemspider.com/Chemical-Structure.4677695.html (accessed 08:33, Mar 29, 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) = 2.12 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 404.92 (Adapted Stein & Brown method) Melting Pt (deg C): 149.46 (Mean or Weighted MP) VP(mm Hg,25 deg C): 7.2E-009 (Modified Grain method) Subcooled liquid VP: 1.33E-007 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): 491.7 log Kow used: 2.12 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 45622 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Hydrazines Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 3.71E-010 atm-m3/mole Group Method: Incomplete Henrys LC [VP/WSol estimate using EPI values]: 4.367E-012 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 2.12 (KowWin est) Log Kaw used: -7.819 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 9.939 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.6159 Biowin2 (Non-Linear Model) : 0.2483 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 2.6516 (weeks-months) Biowin4 (Primary Survey Model) : 3.4848 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.2878 Biowin6 (MITI Non-Linear Model): 0.0908 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.1313 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): 1.77E-005 Pa (1.33E-007 mm Hg) Log Koa (Koawin est ): 9.939 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 0.169 Octanol/air (Koa) model: 0.00213 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.859 Mackay model : 0.931 Octanol/air (Koa) model: 0.146 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 9.9045 E-12 cm3/molecule-sec Half-Life = 1.080 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 12.959 Hrs Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 0.895 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 123.9 Log Koc: 2.093 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 = 0.282 (BCF = 1.912) log Kow used: 2.12 (estimated) Volatilization from Water: Henry LC: 3.71E-010 atm-m3/mole (estimated by Bond SAR Method) Half-Life from Model River: 2.376E+006 hours (9.9E+004 days) Half-Life from Model Lake : 2.592E+007 hours (1.08E+006 days) Removal In Wastewater Treatment: Total removal: 2.37 percent Total biodegradation: 0.10 percent Total sludge adsorption: 2.27 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 0.0269 25.9 1000 Water 21.1 900 1000 Soil 78.7 1.8e+003 1000 Sediment 0.0948 8.1e+003 0 Persistence Time: 1.45e+003 hr
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