ChemSpider 2D Image | Pangamic acid | C10H19NO8

Pangamic acid

  • Molecular FormulaC10H19NO8
  • Average mass281.260 Da
  • Monoisotopic mass281.111053 Da
  • ChemSpider ID32700433

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

20858-86-0 [RN]
6-O-(N,N-Dimethylglycyl)-D-gluconic acid [ACD/IUPAC Name]
6-O-(N,N-Dimethylglycyl)-D-gluconsäure [German] [ACD/IUPAC Name]
Acide 6-O-(N,N-diméthylglycyl)-D-gluconique [French] [ACD/IUPAC Name]
D-Gluconic acid, 6-[2-(dimethylamino)acetate] [ACD/Index Name]
MPQ53A9F5C
Pangamic acid [Wiki]
UNII-MPQ53A9F5C
(2R,3S,4R,5R)-6-[2-(dimethylamino)acetyl]oxy-2,3,4,5-tetrahydroxyhexanoic acid
12770-30-8 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 571.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.5±6.0 kJ/mol
Flash Point: 299.6±30.1 °C
Index of Refraction: 1.558
Molar Refractivity: 61.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: -1.69
ACD/LogD (pH 5.5): -4.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 148 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 74.0±3.0 dyne/cm
Molar Volume: 190.5±3.0 cm3

Click to predict properties on the Chemicalize site


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