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Search term: CCIVGXIOQKPBKL (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (2,2,2-~2~H_3_)Ethanesulfonic acid | C2H3D3O3S

(2,2,2-2H3)Ethanesulfonic acid

  • Molecular FormulaC2H3D3O3S
  • Average mass113.151 Da
  • Monoisotopic mass113.022591 Da
  • ChemSpider ID68897283
  • Non-standard isotope - Non-standard isotope


More details:






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

(2,2,2-2H3)Ethanesulfonic acid [ACD/IUPAC Name]
(2,2,2-2H3)Ethansulfonsäure [German] [ACD/IUPAC Name]
Acide (2,2,2-2H3)éthanesulfonique [French] [ACD/IUPAC Name]
Ethane-2,2,2-d3-sulfonic acid [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 394.9±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.453
Molar Refractivity: 21.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.36
ACD/LogD (pH 5.5): -4.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 8.6±0.5 10-24cm3
Surface Tension: 48.8±3.0 dyne/cm
Molar Volume: 80.1±3.0 cm3

Click to predict properties on the Chemicalize site






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