ChemSpider 2D Image | 3-C-Carboxy-2-deoxy-D-erythro-pentaric acid | C6H8O8

3-C-Carboxy-2-deoxy-D-erythro-pentaric acid

  • Molecular FormulaC6H8O8
  • Average mass208.123 Da
  • Monoisotopic mass208.021912 Da
  • ChemSpider ID61711170

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(4ξ)-3-C-Carboxy-2-deoxy-D-glycero-pentaric acid [ACD/IUPAC Name]
(4ξ)-3-C-Carboxy-2-desoxy-D-glycero-pentarsäure [German] [ACD/IUPAC Name]
3-C-Carboxy-2-deoxy-D-erythro-pentaric acid [ACD/IUPAC Name]
3-C-Carboxy-2-desoxy-D-erythro-pentarsäure [German] [ACD/IUPAC Name]
Acide (4ξ)-3-C-carboxy-2-désoxy-D-glycéro-pentarique [French] [ACD/IUPAC Name]
Acide 3-C-carboxy-2-désoxy-D-érythro-pentarique [French] [ACD/IUPAC Name]
D-erythro-Pentaric acid, 3-C-carboxy-2-deoxy- [ACD/Index Name]
D-glycero-Pentaric acid, 3-C-carboxy-2-deoxy-, (4ξ)- [ACD/Index Name]
CITRATE ANION
FLC

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

Density: 1.9±0.1 g/cm3
Boiling Point: 393.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 74.4±6.0 kJ/mol
Flash Point: 205.8±24.4 °C
Index of Refraction: 1.620
Molar Refractivity: 37.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -1.35
ACD/LogD (pH 5.5): -7.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 152 Å2
Polarizability: 14.9±0.5 10-24cm3
Surface Tension: 131.8±3.0 dyne/cm
Molar Volume: 106.9±3.0 cm3

Click to predict properties on the Chemicalize site


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