ChemSpider 2D Image | Methyl 3-deoxy-2-O-(4-methylbenzoyl)-3-[(4-methylbenzoyl)amino]-beta-D-talopyranoside | C23H27NO7

Methyl 3-deoxy-2-O-(4-methylbenzoyl)-3-[(4-methylbenzoyl)amino]-β-D-talopyranoside

  • Molecular FormulaC23H27NO7
  • Average mass429.463 Da
  • Monoisotopic mass429.178741 Da
  • ChemSpider ID26326668

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

3-Désoxy-2-O-(4-méthylbenzoyl)-3-[(4-méthylbenzoyl)amino]-β-D-talopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 3-deoxy-2-O-(4-methylbenzoyl)-3-[(4-methylbenzoyl)amino]-β-D-talopyranoside [ACD/IUPAC Name]
Methyl-3-desoxy-2-O-(4-methylbenzoyl)-3-[(4-methylbenzoyl)amino]-β-D-talopyranosid [German] [ACD/IUPAC Name]
β-D-Talopyranoside, methyl 3-deoxy-3-[(4-methylbenzoyl)amino]-, 2-(4-methylbenzoate) [ACD/Index Name]
DQT

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

Density: 1.3±0.1 g/cm3
Boiling Point: 656.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.6±3.0 kJ/mol
Flash Point: 351.1±31.5 °C
Index of Refraction: 1.603
Molar Refractivity: 112.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.95
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.91
ACD/KOC (pH 5.5): 779.14
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.91
ACD/KOC (pH 7.4): 779.13
Polar Surface Area: 114 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 327.2±5.0 cm3

Click to predict properties on the Chemicalize site


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