ChemSpider 2D Image | (1S)-1,5-Anhydro-1-sulfamoyl-D-galactitol | C6H13NO7S

(1S)-1,5-Anhydro-1-sulfamoyl-D-galactitol

  • Molecular FormulaC6H13NO7S
  • Average mass243.235 Da
  • Monoisotopic mass243.041275 Da
  • ChemSpider ID24632110
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

(1S)-1,5-Anhydro-1-sulfamoyl-D-galactitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-sulfamoyl-D-galactitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-sulfamoyl-D-galactitol [French] [ACD/IUPAC Name]
(2s,3r,4s,5r,6r)-3,4,5-Trihydroxy-6-(Hydroxymethyl)oxane-2-Sulfonamide
D-Galactitol, 1-C-(aminosulfonyl)-1,5-anhydro-, (1S)- [ACD/Index Name]
1SD

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

Density: 1.8±0.1 g/cm3
Boiling Point: 576.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 99.1±6.0 kJ/mol
Flash Point: 302.3±32.9 °C
Index of Refraction: 1.643
Molar Refractivity: 48.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.89
ACD/LogD (pH 5.5): -2.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.21
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.19
Polar Surface Area: 159 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 108.3±5.0 dyne/cm
Molar Volume: 132.8±5.0 cm3

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