ChemSpider 2D Image | 1-O-(2-Propylpentanoyl)hexopyranuronic acid | C14H24O8

1-O-(2-Propylpentanoyl)hexopyranuronic acid

  • Molecular FormulaC14H24O8
  • Average mass320.336 Da
  • Monoisotopic mass320.147125 Da
  • ChemSpider ID20483618

More details:

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

1-O-(2-Propylpentanoyl)hexopyranuronic acid [ACD/IUPAC Name]
1-O-(2-Propylpentanoyl)hexopyranuronsäure [German] [ACD/IUPAC Name]
3,4,5-trihydroxy-6-(2-propyl-pentanoyloxy)-tetrahydro-pyran-2-carboxylic acid
3,4,5-Trihydroxy-6-[(2-propylpentanoyl)oxy]tetrahydro-2H-pyran-2-carbonsäure [German]
3,4,5-Trihydroxy-6-[(2-propylpentanoyl)oxy]tetrahydro-2H-pyran-2-carboxylic acid
Acide 1-O-(2-propylpentanoyl)hexopyranuronique [French] [ACD/IUPAC Name]
Acide 3,4,5-trihydroxy-6-[(2-propylpentanoyl)oxy]tétrahydro-2H-pyran-2-carboxylique [French]
Hexopyranuronic acid, 1-O-(1-oxo-2-propylpentyl)- [ACD/Index Name]
60113-83-9 [RN]
VALPROIC ACID &β;-D-GLUCURONIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 491.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.4±6.0 kJ/mol
Flash Point: 178.0±22.2 °C
Index of Refraction: 1.532
Molar Refractivity: 74.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): -2.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 134 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 240.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement