ChemSpider 2D Image | N-[(6-Chloro-2-oxo-2H-chromen-3-yl)carbonyl]threonine | C14H12ClNO6

N-[(6-Chloro-2-oxo-2H-chromen-3-yl)carbonyl]threonine

  • Molecular FormulaC14H12ClNO6
  • Average mass325.701 Da
  • Monoisotopic mass325.035309 Da
  • ChemSpider ID120441290

More details:

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

N-[(6-Chlor-2-oxo-2H-chromen-3-yl)carbonyl]threonin [German] [ACD/IUPAC Name]
N-[(6-Chloro-2-oxo-2H-chromen-3-yl)carbonyl]threonine [ACD/IUPAC Name]
N-[(6-Chloro-2-oxo-2H-chromén-3-yl)carbonyl]thréonine [French] [ACD/IUPAC Name]
Threonine, N-[(6-chloro-2-oxo-2H-1-benzopyran-3-yl)carbonyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 688.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.0±3.0 kJ/mol
Flash Point: 370.0±31.5 °C
Index of Refraction: 1.628
Molar Refractivity: 74.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): -1.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 209.5±3.0 cm3

Click to predict properties on the Chemicalize site


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