embed iframe Mention this document CSID:10775, http://www.pilsadiet.com/Chemical-Structure.10775.html (accessed 19:49, Oct 26, 2021) CopyCopied p Extra A lot more div br table Thickness: 0.7 ± 0.1 g/cm3 tr Boiling Factor: 55.8 ± 7.0 ° C at 760 mmHg tr td Vapour Stress: 245.6 ± 0.0 mmHg at 25°° C td tr td Enthalpy of Evaporation: 28.6 ± 0.8 kJ/mol tr td Blink Factor:. td -18.3 ± 0.0 ° C td tr td Index of Refraction: td 1.394 td Molar Refractivity: 29.4 ± 0.3 cm3 td tr #H bond acceptors: 0 td #H bond benefactors: td 0 tr #Freely Revolving Bonds: td 1 td tr #Rule of 5 Infractions: 0 td tr ACD/LogP: td 3.27 td tr ACD/LogD(pH 5.5): td 2.88 td ACD/BCF(pH 5.5): 91.33 td ACD/KOC (pH 5.5): td 881.08 td tr td ACD/LogD (pH 7.4): td 2.88 tr ACD/BCF (pH 7.4): td 91.33 tr ACD/KOC (pH 7.4): 881.08 td tr td Polar Area: td 0 Å 2 td tr Polarizability: 11.6 ± 0.5 10-24cm3 td tr Surface area Stress: td 18.1 ± 3.0 dyne/cm td tr Molar Quantity: td 122.8 ± 3.0 cm3 Anticipated information is produced making use of the United States Epa's EPISuite ™ solid Log Octanol-Water Dividers Coef (SRC): Log Kow(KOWWIN v1.67 quote)=3.13 Boiling Pt, Thawing Pt, Vapor Stress Evaluations (MPBPWIN v1.42 ): Boiling Pt (deg C): 47.29(Adjusted Stein & Brown technique)Melting Pt(deg C): -116.27(Mean or Heavy MP)VP( mm Hg,25 deg C ): 248(Mean VP of Antoine & Grain approaches)MP(exp data source): -157.3 deg C BP (exp data source): 55.6 deg C VP(exp data source): 2.52 E +02 mm Hg at 25 deg C Water Solubility Price Quote from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C( mg/L ): 78.47 log Kow utilized: 3.13(approximated)no-melting pt formula utilized Water Sol Price quote from Fragments: Wat Sol(v1.01 est)=96.847 mg/L ECOSAR Course Program(ECOSAR v0.99 h): Course(es)discovered: Neutral Organics Henrys Regulation Consistent (25 deg C) : Bond Technique: 4.23E-001 atm-m3/ mole Team Approach: Insufficient Henrys LC : 3.500E-001 atm-m3/ mole Log Octanol-Air Dividers Coefficient(25 deg C): Log Kow made use of: 3.13 (KowWin est)Log Kaw utilized: 1.238 (HenryWin est)Log Koa(KOAWIN v1.10 quote): 1.892 Log Koa(speculative data source): None Possibility of Fast Biodegradation(BIOWIN v4.10): Biowin1(Direct Version): 0.7075 Biowin2 (Non-Linear Design): 0.8598 Professional Study Biodegradation Outcomes: Biowin3 (Ultimate Study Design): 3.0132 (weeks)Biowin4(Main Study Design): 3.7263 (days-weeks)MITI Biodegradation Possibility: Biowin5 (MITI Linear Version): 0.4247 Biowin6 (MITI Non-Linear Design ): 0.5279 Anaerobic Biodegradation Likelihood: Biowin7(Anaerobic Linear Design ): 0.2845 Ready Biodegradability Forecast: NO Hydrocarbon Biodegradation (BioHCwin v1.01): LOG BioHC Half-Life (days): 0.4768 BioHC Half-Life (days): 2.9980 Sorption to aerosols (25 Dec C) : Vapor stress (liquid/subcooled): 3.36 E +004 (252 mm Hg) Log Koa (Koawin est ): 1.892 Kp (particle/gas dividing coef. (m3/ug)): Mackay design: 8.93E-011 Octanol/air (Koa) version: 1.91E-011 Portion sorbed to air-borne particulates (phi): Junge-Pankow design: 3.23E-009 Mackay version: 7.14E-009 Octanol/air (Koa) version: 1.53E-009 Climatic Oxidation (25 deg C) : Hydroxyl Radicals Response: OVERALL OH Price Consistent = 53.8106 E-12 cm3/molecule-sec Half-Life = 0.199 Days (12-hr day; 1.5 E6 OH/cm3) Half-Life = 2.385 Humans Resources Ozone Response: OVERALL Ozone Price Continuous = 1.200000 E-17 cm3/molecule-sec Half-Life = 0.955 Days (at 7E11 mol/cm3) Half-Life = 22.920 Humans resources Portion sorbed to air-borne particulates (phi): 5.18E-009 (Junge, Mackay) Note: the sorbed portion might be immune to climatic oxidation Dirt Adsorption Coefficient (PCKOCWIN v1.66): Koc: 106.8 Log Koc: 2.029 Liquid Base/Acid-Catalyzed Hydrolysis (25 deg C) : Price constants can NOT be approximated for this framework! Bioaccumulation Quotes from Log Kow (BCFWIN v2.17): Log BCF from regression-based technique = 1.713 (BCF = 51.69) log Kow made use of: 3.13 (approximated) Volatilization from Water: Henry LC: 0.423 atm-m3/ mole (approximated by Bond SAR Approach) Half-Life from Version River: 0.9374 hrs (56.24 minutes) Half-Life from Design Lake: 87.15 hrs (3.631 days) Elimination In Wastewater Therapy (advised optimum 95%): Overall elimination: 99.40 percent Complete biodegradation: 0.03 percent Overall sludge adsorption: 3.29 percent Overall to Air: 96.09 percent (utilizing 10000 human resources Biography P, A, S) Degree III Fugacity Version: Mass Quantity Half-Life Emissions (percent) (human resources) (kg/hr) Air 6.25 3.95 1000 Water 87.2 360 1000 Dirt 4.63 720 1000 Debris 1.86 3.24 e +003 0 Perseverance Time: 70.4 human resources br div Click to anticipate residential properties on the Chemicalize website p Look pilsadiet.com: h3 Look Google: h3 td Patents td Individual Collections td tr td Magazine or Publication Short Article Online Short article (blog site or discourse) td Readily Available Chemicals Data Sources td Organic Residences tr Chain reaction td Chemical Safety And Security Information tr Medications or Substances in Growth td Imaging Representatives tr Info Collectors td Journal Publishers by means of MeSH Ligand/binding/crystal Framework Data Sources td Metabolic Pathways tr td Molecular Libraries Testing Facility Network td All-natural Products td NIH Compound Database td Physical Residence (consisting of SAR/QSAR data sources) td tr td Healthy Protein 3D Frameworks Spectroscopy Data sources td tr td Material Suppliers td Academic Characteristics tr Toxicology/Environmental Data sources td Online Collection td