ChemSpider 2D Image | (6R)-5-Amino-1,3,5-trideoxy-6-[(1S,2R)-1,2,3-trihydroxypropyl]-alpha-L-threo-hex-2-ulopyranose | C9H19NO6

(6R)-5-Amino-1,3,5-trideoxy-6-[(1S,2R)-1,2,3-trihydroxypropyl]-α-L-threo-hex-2-ulopyranose

  • Molecular FormulaC9H19NO6
  • Average mass237.250 Da
  • Monoisotopic mass237.121231 Da
  • ChemSpider ID57486938

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(6R)-5-Amino-1,3,5-trideoxy-6-[(1S,2R)-1,2,3-trihydroxypropyl]-α-L-threo-hex-2-ulopyranose [ACD/IUPAC Name]
(6R)-5-Amino-1,3,5-tridesoxy-6-[(1S,2R)-1,2,3-trihydroxypropyl]-α-L-threo-hex-2-ulopyranose [German] [ACD/IUPAC Name]
(6R)-5-Amino-1,3,5-tridésoxy-6-[(1S,2R)-1,2,3-trihydroxypropyl]-α-L-thréo-hex-2-ulopyranose [French] [ACD/IUPAC Name]
D-glycero-α-L-altro-2-Nonulopyranose, 5-amino-1,3,5-trideoxy- [ACD/Index Name]
(1S,2R)-1-[(2R,3R,4S,6R)-3-AMINO-4,6-DIHYDROXY-6-METHYL-OXAN-2-YL]PROPANE-1,2,3-TRIOL

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

Density: 1.5±0.1 g/cm3
Boiling Point: 535.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.4±6.0 kJ/mol
Flash Point: 277.9±30.1 °C
Index of Refraction: 1.585
Molar Refractivity: 54.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 7
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -2.31
ACD/LogD (pH 5.5): -4.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 136 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 77.6±3.0 dyne/cm
Molar Volume: 162.5±3.0 cm3

Click to predict properties on the Chemicalize site


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