ChemSpider 2D Image | 6-(2,3-Dihydroxypropoxy)-5-Acetamido-5,6-Dihydro-4-Hydroxy-4h-Pyran-2-Carboxylic Acid | C11H17NO8

6-(2,3-Dihydroxypropoxy)-5-Acetamido-5,6-Dihydro-4-Hydroxy-4h-Pyran-2-Carboxylic Acid

  • Molecular FormulaC11H17NO8
  • Average mass291.255 Da
  • Monoisotopic mass291.095428 Da
  • ChemSpider ID25057238

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R)-2,3-Dihydroxypropyl 2-acetamido-2,4-dideoxy-α-L-threo-hex-4-enopyranosiduronic acid [ACD/IUPAC Name]
(2R)-2,3-Dihydroxypropyl-2-acetamido-2,4-didesoxy-α-L-threo-hex-4-enopyranosiduronsäure [German] [ACD/IUPAC Name]
6-(2,3-Dihydroxypropoxy)-5-Acetamido-5,6-Dihydro-4-Hydroxy-4h-Pyran-2-Carboxylic Acid
Acide 2-acétamido-2,4-didésoxy-α-L-thréo-hex-4-énopyranosiduronique de (2R)-2,3-dihydroxypropyle [French] [ACD/IUPAC Name]
α-L-threo-Hex-4-enopyranosiduronic acid, (2R)-2,3-dihydroxypropyl 2-(acetylamino)-2,4-dideoxy- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 734.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.4±6.0 kJ/mol
Flash Point: 398.2±32.9 °C
Index of Refraction: 1.583
Molar Refractivity: 64.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.44
ACD/LogD (pH 5.5): -4.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 75.3±5.0 dyne/cm
Molar Volume: 191.5±5.0 cm3

Click to predict properties on the Chemicalize site


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