ChemSpider 2D Image | Methyl 2-(benzoylamino)-2-deoxy-6-O-[(4-methylphenyl)sulfonyl]-alpha-L-galactopyranoside | C21H25NO8S

Methyl 2-(benzoylamino)-2-deoxy-6-O-[(4-methylphenyl)sulfonyl]-α-L-galactopyranoside

  • Molecular FormulaC21H25NO8S
  • Average mass451.490 Da
  • Monoisotopic mass451.130096 Da
  • ChemSpider ID62618865

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-(Benzoylamino)-2-désoxy-6-O-[(4-méthylphényl)sulfonyl]-α-L-galactopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 2-(benzoylamino)-2-deoxy-6-O-[(4-methylphenyl)sulfonyl]-α-L-galactopyranoside [ACD/IUPAC Name]
Methyl-2-(benzoylamino)-2-desoxy-6-O-[(4-methylphenyl)sulfonyl]-α-L-galactopyranosid [German] [ACD/IUPAC Name]
α-L-Galactopyranoside, methyl 2-(benzoylamino)-2-deoxy-, 6-(4-methylbenzenesulfonate) [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: 713.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.6±3.0 kJ/mol
Flash Point: 385.6±32.9 °C
Index of Refraction: 1.622
Molar Refractivity: 111.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 7.66
ACD/KOC (pH 5.5): 149.46
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 7.66
ACD/KOC (pH 7.4): 149.46
Polar Surface Area: 140 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 65.9±5.0 dyne/cm
Molar Volume: 317.6±5.0 cm3

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