ChemSpider 2D Image | N-Acetyl-2,3-dihydroxy-L-aspartic acid | C6H9NO7

N-Acetyl-2,3-dihydroxy-L-aspartic acid

  • Molecular FormulaC6H9NO7
  • Average mass207.138 Da
  • Monoisotopic mass207.037903 Da
  • ChemSpider ID24223244

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Acide N-acétyl-2,3-dihydroxy-L-aspartique [French] [ACD/IUPAC Name]
L-Aspartic acid, N-acetyl-2,3-dihydroxy- [ACD/Index Name]
N-Acetyl-2,3-dihydroxy-L-asparaginsäure [German] [ACD/IUPAC Name]
N-Acetyl-2,3-dihydroxy-L-aspartic acid [ACD/IUPAC Name]
(2R)-2-acetamido-2,3-dihydroxysuccinic acid
459811-82-6 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 560.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.5 mmHg at 25°C
Enthalpy of Vaporization: 96.9±6.0 kJ/mol
Flash Point: 292.9±30.1 °C
Index of Refraction: 1.585
Molar Refractivity: 39.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.22
ACD/LogD (pH 5.5): -5.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 144 Å2
Polarizability: 15.7±0.5 10-24cm3
Surface Tension: 99.6±3.0 dyne/cm
Molar Volume: 118.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement