ChemSpider 2D Image | 2R-amino-4S-hydroxy-5-hexynoic acid | C6H9NO3

2R-amino-4S-hydroxy-5-hexynoic acid

  • Molecular FormulaC6H9NO3
  • Average mass143.141 Da
  • Monoisotopic mass143.058243 Da
  • ChemSpider ID28289723

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(2R,4S)-2-Amino-4-hydroxy-5-hexinsäure [German] [ACD/IUPAC Name]
(2R,4S)-2-Amino-4-hydroxy-5-hexynoic acid [ACD/IUPAC Name]
2R-amino-4S-hydroxy-5-hexynoic acid
5-Hexynoic acid, 2-amino-4-hydroxy-, (2R,4S)- [ACD/Index Name]
Acide (2R,4S)-2-amino-4-hydroxy-5-hexynoïque [French] [ACD/IUPAC Name]
1373258-95-7 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 373.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.9±6.0 kJ/mol
Flash Point: 179.9±27.9 °C
Index of Refraction: 1.547
Molar Refractivity: 34.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.39
ACD/LogD (pH 5.5): -3.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 13.6±0.5 10-24cm3
Surface Tension: 70.1±3.0 dyne/cm
Molar Volume: 107.9±3.0 cm3

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