ChemSpider 2D Image | 3-O-Acetyl-3-C-carboxy-5-deoxy-D-erythro-pent-4-ulosonic acid | C8H10O8

3-O-Acetyl-3-C-carboxy-5-deoxy-D-erythro-pent-4-ulosonic acid

  • Molecular FormulaC8H10O8
  • Average mass234.160 Da
  • Monoisotopic mass234.037567 Da
  • ChemSpider ID28293971

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

3-O-Acetyl-3-C-carboxy-5-deoxy-D-erythro-pent-4-ulosonic acid [ACD/IUPAC Name]
Acide 3-O-acétyl-3-C-carboxy-5-désoxy-D-érythro-pent-4-ulosonique [French] [ACD/IUPAC Name]
D-erythro-4-Pentulosonic acid, 3-C-carboxy-5-deoxy-, 3-acetate [ACD/Index Name]
(-)-Diacetyl-L-tartaric Acid
(-)-DIACETYL-L-TARTARICACID

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

Density: 1.6±0.1 g/cm3
Boiling Point: 468.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 84.3±6.0 kJ/mol
Flash Point: 189.8±22.2 °C
Index of Refraction: 1.525
Molar Refractivity: 45.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.89
ACD/LogD (pH 5.5): -4.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 138 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 72.5±3.0 dyne/cm
Molar Volume: 148.4±3.0 cm3

Click to predict properties on the Chemicalize site


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