ChemSpider 2D Image | 1,5-Anhydro-2,3-dideoxy-3-[(3,5-dichloro-4-methoxybenzoyl)amino]-D-threo-pentitol | C13H15Cl2NO4

1,5-Anhydro-2,3-dideoxy-3-[(3,5-dichloro-4-methoxybenzoyl)amino]-D-threo-pentitol

  • Molecular FormulaC13H15Cl2NO4
  • Average mass320.168 Da
  • Monoisotopic mass319.037811 Da
  • ChemSpider ID35079114

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,5-Anhydro-2,3-dideoxy-3-[(3,5-dichloro-4-methoxybenzoyl)amino]-D-threo-pentitol [ACD/IUPAC Name]
1,5-Anhydro-2,3-didesoxy-3-[(3,5-dichlor-4-methoxybenzoyl)amino]-D-threo-pentitol [German] [ACD/IUPAC Name]
1,5-Anhydro-2,3-didésoxy-3-[(3,5-dichloro-4-méthoxybenzoyl)amino]-D-thréo-pentitol [French] [ACD/IUPAC Name]
D-threo-Pentitol, 1,5-anhydro-2,3-dideoxy-3-[(3,5-dichloro-4-methoxybenzoyl)amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 461.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 232.9±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 75.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.86
ACD/KOC (pH 5.5): 414.59
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.86
ACD/KOC (pH 7.4): 414.58
Polar Surface Area: 68 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 56.8±5.0 dyne/cm
Molar Volume: 223.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement