ChemSpider 2D Image | O,O-Bis[(~2~H_3_)methyl] O-(4-sulfamoylphenyl) phosphorothioate | C8H6D6NO5PS2

O,O-Bis[(2H3)methyl] O-(4-sulfamoylphenyl) phosphorothioate

  • Molecular FormulaC8H6D6NO5PS2
  • Average mass303.325 Da
  • Monoisotopic mass303.027100 Da
  • ChemSpider ID48063453

  • Non-standard isotope - Non-standard isotope

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

O,O-Bis[(2H3)methyl] O-(4-sulfamoylphenyl) phosphorothioate [ACD/IUPAC Name]
O,O-Bis[(2H3)methyl]-O-(4-sulfamoylphenyl)phosphorothioat [German] [ACD/IUPAC Name]
Phosphorothioate de O,O-bis[(2H3)méthyle] et de O-(4-sulfamoylphényle) [French] [ACD/IUPAC Name]
Phosphorothioic acid, O-[4-(aminosulfonyl)phenyl] O,O-dimethyl-d3 ester [ACD/Index Name]
1794737-40-8 [RN]
4-[bis(trideuteriomethoxy)phosphinothioyloxy]benzenesulfonamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 407.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 200.3±31.5 °C
Index of Refraction: 1.576
Molar Refractivity: 67.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 9.20
ACD/KOC (pH 5.5): 170.39
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 9.18
ACD/KOC (pH 7.4): 170.01
Polar Surface Area: 138 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 203.6±3.0 cm3

Click to predict properties on the Chemicalize site


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