ChemSpider 2D Image | 1,4-Anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(methylsulfonyl)amino]-D-arabinitol | C8H18N2O4S

1,4-Anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(methylsulfonyl)amino]-D-arabinitol

  • Molecular FormulaC8H18N2O4S
  • Average mass238.305 Da
  • Monoisotopic mass238.098724 Da
  • ChemSpider ID29858560

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1,4-Anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(methylsulfonyl)amino]-D-arabinitol [ACD/IUPAC Name]
1,4-Anhydro-2,5-didesoxy-2-(dimethylamino)-5-[(methylsulfonyl)amino]-D-arabinitol [German] [ACD/IUPAC Name]
1,4-Anhydro-2,5-didésoxy-2-(diméthylamino)-5-[(méthylsulfonyl)amino]-D-arabinitol [French] [ACD/IUPAC Name]
D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(methylsulfonyl)amino]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 404.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.8±6.0 kJ/mol
Flash Point: 198.4±31.5 °C
Index of Refraction: 1.533
Molar Refractivity: 56.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.65
ACD/LogD (pH 5.5): -3.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 50.7±5.0 dyne/cm
Molar Volume: 182.3±5.0 cm3

Click to predict properties on the Chemicalize site


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