ChemSpider 2D Image | (3R,4R,5S,6S)-6-Acetamido-4,5-dihydroxy-3-piperidinecarboxylic acid | C8H14N2O5

(3R,4R,5S,6S)-6-Acetamido-4,5-dihydroxy-3-piperidinecarboxylic acid

  • Molecular FormulaC8H14N2O5
  • Average mass218.207 Da
  • Monoisotopic mass218.090271 Da
  • ChemSpider ID110545393

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3R,4R,5S,6S)-6-Acetamido-4,5-dihydroxy-3-piperidincarbonsäure [German] [ACD/IUPAC Name]
(3R,4R,5S,6S)-6-Acetamido-4,5-dihydroxy-3-piperidinecarboxylic acid [ACD/IUPAC Name]
3-Piperidinecarboxylic acid, 6-(acetylamino)-4,5-dihydroxy-, (3R,4R,5S,6S)- [ACD/Index Name]
Acide (3R,4R,5S,6S)-6-acétamido-4,5-dihydroxy-3-pipéridinecarboxylique [French] [ACD/IUPAC 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: 579.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 99.5±6.0 kJ/mol
Flash Point: 304.1±30.1 °C
Index of Refraction: 1.581
Molar Refractivity: 49.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -2.01
ACD/LogD (pH 5.5): -4.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 119 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 73.1±5.0 dyne/cm
Molar Volume: 147.3±5.0 cm3

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