ChemSpider 2D Image | Caramboxin | C11H13NO6

Caramboxin

  • Molecular FormulaC11H13NO6
  • Average mass255.224 Da
  • Monoisotopic mass255.074280 Da
  • ChemSpider ID32779488

More details:






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

2-Carboxy-3-hydroxy-5-methoxyphenylalanin [German] [ACD/IUPAC Name]
2-Carboxy-3-hydroxy-5-methoxyphenylalanine [ACD/IUPAC Name]
2-Carboxy-3-hydroxy-5-méthoxyphénylalanine [French] [ACD/IUPAC Name]
Caramboxin [Wiki]
Phenylalanine, 2-carboxy-3-hydroxy-5-methoxy- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 494.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 252.8±28.7 °C
Index of Refraction: 1.625
Molar Refractivity: 61.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.14
ACD/LogD (pH 5.5): -2.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 130 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 74.0±3.0 dyne/cm
Molar Volume: 172.4±3.0 cm3

Click to predict properties on the Chemicalize site





Feedback Form