ChemSpider 2D Image | (2R)-2,3-Dihydroxy-4-oxo-4-(propylamino)butanoic acid | C7H13NO5

(2R)-2,3-Dihydroxy-4-oxo-4-(propylamino)butanoic acid

  • Molecular FormulaC7H13NO5
  • Average mass191.182 Da
  • Monoisotopic mass191.079376 Da
  • ChemSpider ID71360750

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2R)-2,3-Dihydroxy-4-oxo-4-(propylamino)butanoic acid [ACD/IUPAC Name]
(2R)-2,3-Dihydroxy-4-oxo-4-(propylamino)butansäure [German] [ACD/IUPAC Name]
Acide (2R)-2,3-dihydroxy-4-oxo-4-(propylamino)butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2,3-dihydroxy-4-oxo-4-(propylamino)-, (2R)- [ACD/Index Name]
n-propyl-tartramic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 519.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 91.2±6.0 kJ/mol
Flash Point: 268.2±30.1 °C
Index of Refraction: 1.520
Molar Refractivity: 42.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.33
ACD/LogD (pH 5.5): -3.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 61.8±3.0 dyne/cm
Molar Volume: 140.4±3.0 cm3

Click to predict properties on the Chemicalize site


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