- Non-standard isotope
[(2H3)Methylsulfinyl](2H3)methane
[2H]C([2H])([2H])S(=O)C([2H])([2H])[2H] CopyCopied
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3/i1D3,2D3 CopyCopied
IAZDPXIOMUYVGZ-WFGJKAKNSA-N CopyCopied
Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts
[(2H3)Methylsulfinyl](2H3)methane [ACD/IUPAC Name]
Bis[(2H3)methyl] sulfoxide
d6-DMSO [Formula]
deuterated DMSO
Dimethyl sulfoxide-d6
Dimethyl-d6 Sulfoxide
Dimethylsulfoxide-D6
DMSO-d6
Hexadeuteriodimethyl sulfoxide
Hexadeuterodimethyl sulfoxide
methane-d3, 1,1'-sulfinylbis-
(Methyl sulfoxide)-d6; DMSO-d6; Hexadeuterodimethyl sulfoxide
218-617-0 [EINECS]
2206-27-1 [RN]
BIS(TRIDEUTERIOMETHYL) SULFOXIDE
Di((2H3)methyl) sulphoxide
Dimethylsulphoxide D6 >99%
Dimethylsulphoxide D6 >99%+0.03% TMS
Dimethylsulphoxide D6 >99.8%
Dimethylsulphoxide D6 >99.8% (septum vials)
Dimethylsulphoxide D6 >99.8%+0.03% TMS
Dimethylsulphoxide D6 >99.8%+0.06% TMS
Dimethylsulphoxide D6 >99.8%+0.1% tms
Dimethylsulphoxide D6 >99.96%
Dimethylsulphoxide D6 >99.96%+ 0.03% TMS
Dimethylsulphoxide D6 >99.96%septum vials
DMSO D6
Methane-d3, sulfinylbis-
Methane-D3-, sulfinylbis-
氘代二甲基亚砜 [Chinese]
151874_ALDRICH [DBID]
156914_ALDRICH [DBID]
175943_ALDRICH [DBID]
185965_ALDRICH [DBID]
236926_ALDRICH [DBID]
236934_ALDRICH [DBID]
296147_ALDRICH [DBID]
308838_ALDRICH [DBID]
417904_ALDRICH [DBID]
417912_ALDRICH [DBID]
417920_ALDRICH [DBID]
417939_ALDRICH [DBID]
423653_ALDRICH [DBID]
424005_ALDRICH [DBID]
437697_ALDRICH [DBID]
439037_ALDRICH [DBID]
441392_ALDRICH [DBID]
444766_ALDRICH [DBID]
453323_ALDRICH [DBID]
479071_ALDRICH [DBID]
522058_ALDRICH [DBID]
522120_ALDRICH [DBID]
545880_ALDRICH [DBID]
547239_ALDRICH [DBID]
569585_ALDRICH [DBID]
570672_ALDRICH [DBID]
574341_ALDRICH [DBID]
612324_ALDRICH [DBID]
Data supplied by datasources and users.
Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.
Predicted data is generated using the US Environmental Protection Agency’s EPISuite™, for more information see their website.
Log Octanol-Water Partition Coef (SRC): Log Kow (KOWWIN v1.67 estimate) = -1.22 Log Kow (Exper. database match) = -1.35 Exper. Ref: Hansch,C et al. (1995) Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPWIN v1.42): Boiling Pt (deg C): 128.63 (Adapted Stein & Brown method) Melting Pt (deg C): -49.71 (Mean or Weighted MP) VP(mm Hg,25 deg C): 0.622 (Mean VP of Antoine & Grain methods) MP (exp database): 18.5 deg C BP (exp database): 189 deg C VP (exp database): 6.10E-01 mm Hg at 25 deg C Water Solubility Estimate from Log Kow (WSKOW v1.41): Water Solubility at 25 deg C (mg/L): 1e+006 log Kow used: -1.35 (expkow database) no-melting pt equation used Water Sol (Exper. database match) = 1e+006 mg/L ( deg C) Exper. Ref: DORIGAN,J ET AL. (1976A) @2ND Water Sol Estimate from Fragments: Wat Sol (v1.01 est) = 1e+006 mg/L Wat Sol (Exper. database match) = 1000000.00 Exper. Ref: DORIGAN,J ET AL. (1976A) @2ND ECOSAR Class Program (ECOSAR v0.99h): Class(es) found: Neutral Organics Henrys Law Constant (25 deg C) [HENRYWIN v3.10]: Bond Method : 4.96E-008 atm-m3/mole Group Method: Incomplete Exper Database: 1.51E-09 atm-m3/mole Henrys LC [VP/WSol estimate using EPI values]: 6.394E-008 atm-m3/mole Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]: Log Kow used: -1.35 (exp database) Log Kaw used: -7.209 (exp database) Log Koa (KOAWIN v1.10 estimate): 5.859 Log Koa (experimental database): 4.960 Probability of Rapid Biodegradation (BIOWIN v4.10): Biowin1 (Linear Model) : 0.7104 Biowin2 (Non-Linear Model) : 0.8698 Expert Survey Biodegradation Results: Biowin3 (Ultimate Survey Model): 3.0265 (weeks ) Biowin4 (Primary Survey Model) : 3.7350 (days-weeks ) MITI Biodegradation Probability: Biowin5 (MITI Linear Model) : 0.4805 Biowin6 (MITI Non-Linear Model): 0.5766 Anaerobic Biodegradation Probability: Biowin7 (Anaerobic Linear Model): 0.6769 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): 81.3 Pa (0.61 mm Hg) Log Koa (Exp database): 4.960 Kp (particle/gas partition coef. (m3/ug)): Mackay model : 3.69E-008 Octanol/air (Koa) model: 2.24E-008 Fraction sorbed to airborne particulates (phi): Junge-Pankow model : 1.33E-006 Mackay model : 2.95E-006 Octanol/air (Koa) model: 1.79E-006 Atmospheric Oxidation (25 deg C) [AopWin v1.92]: Hydroxyl Radicals Reaction: OVERALL OH Rate Constant = 62.1216 E-12 cm3/molecule-sec Half-Life = 0.172 Days (12-hr day; 1.5E6 OH/cm3) Half-Life = 2.066 Hrs Ozone Reaction: No Ozone Reaction Estimation Fraction sorbed to airborne particulates (phi): 2.14E-006 (Junge,Mackay) Note: the sorbed fraction may be resistant to atmospheric oxidation Soil Adsorption Coefficient (PCKOCWIN v1.66): Koc : 4.411 Log Koc: 0.645 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 = 0.500 (BCF = 3.162) log Kow used: -1.35 (expkow database) Volatilization from Water: Henry LC: 1.51E-009 atm-m3/mole (Henry experimental database) Half-Life from Model River: 3.427E+005 hours (1.428E+004 days) Half-Life from Model Lake : 3.739E+006 hours (1.558E+005 days) Removal In Wastewater Treatment: Total removal: 1.85 percent Total biodegradation: 0.09 percent Total sludge adsorption: 1.75 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 0.0334 4.14 1000 Water 39.5 360 1000 Soil 60.4 720 1000 Sediment 0.0723 3.24e+003 0 Persistence Time: 557 hr
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