- Double-bond stereo
(1Z,2Z)-Bis(3-fluorobenzylidene)hydrazine
c1cc(cc(c1)/C=N\N=C/c2cc(ccc2)F)F
InChI=1S/C14H10F2N2/c15-13-5-1-3-11(7-13)9-17-18-10-12-4-2-6-14(16)8-12/h1-10H/b17-9-,18-10-
YYMCVDNIIFNDJK-XFQWXJFMSA-N
CSID:4635896, http://www.chemspider.com/Chemical-Structure.4635896.html (accessed 15:12, Apr 20, 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) = 4.88 Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 320.29 (Adapted Stein & Brown method) Melting Pt (deg C): 60.86 (Mean or Weighted MP) VP(mm Hg,25 deg C): 0.000306 (Modified Grain method) Subcooled liquid VP: 0.00066 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): 1.735 log Kow used: 4.88 (estimated) no-melting pt equation used Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 1.0447 mg/L ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Hydrazines Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 5.25E-005 atm-m3/mole Group Method: Incomplete Henrys LC [VP/WSol estimate using EPI values]: 5.668E-005 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: 4.88 (KowWin est) Log Kaw used: -2.668 (HenryWin est) Log Koa (KOAWIN v1.10 estimate): 7.548 Log Koa (experimental database): None Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : -0.9887 Biowin2 (Non-Linear Model) : 0.0000 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 1.8455 (months ) Biowin4 (Primary Survey Model) : 3.5223 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.0665 Biowin6 (MITI Non-Linear Model): 0.0000 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.1388 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): 0.088 Pa (0.00066 mm Hg) Log Koa (Koawin est ): 7.548 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 3.41E-005 Octanol/air (Koa) model: 8.67E-006 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 0.00123 Mackay model : 0.00272 Octanol/air (Koa) model: 0.000693 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 15.4691 E-12 cm3/molecule-sec Half-Life = 0.691 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 8.297 Hrs Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 0.00197 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 1.858E+005 Log Koc: 5.269 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 = 3.057 (BCF = 1139) log Kow used: 4.88 (estimated) Volatilization from Water: Henry LC: 5.25E-005 atm-m3/mole (estimated by Bond SAR Method) Half-Life from Model River: 19.02 hours Half-Life from Model Lake : 338.6 hours (14.11 days) Removal In Wastewater Treatment: Total removal: 73.83 percent Total biodegradation: 0.64 percent Total sludge adsorption: 72.57 percent Total to Air: 0.62 percent (using 10000 hr Bio P,A,S) Level III Fugacity Model: Mass Amount Half-Life Emissions (percent) (hr) (kg/hr) Air 0.398 16.6 1000 Water 8.4 1.44e+003 1000 Soil 71.5 2.88e+003 1000 Sediment 19.7 1.3e+004 0 Persistence Time: 1.94e+003 hr
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