ChemSpider 2D Image | 1-Naphthyl 2-acetamido-2-deoxy-beta-D-erythro-hexopyranoside | C18H21NO6

1-Naphthyl 2-acetamido-2-deoxy-β-D-erythro-hexopyranoside

  • Molecular FormulaC18H21NO6
  • Average mass347.362 Da
  • Monoisotopic mass347.136902 Da
  • ChemSpider ID98606439

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

1-Naphthyl 2-acetamido-2-deoxy-β-D-erythro-hexopyranoside [ACD/IUPAC Name]
1-Naphthyl-2-acetamido-2-desoxy-β-D-erythro-hexopyranosid [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-β-D-érythro-hexopyranoside de 1-naphtyle [French] [ACD/IUPAC Name]
β-D-erythro-Hexopyranoside, 1-naphthalenyl 2-(acetylamino)-2-deoxy- [ACD/Index Name]
10329-98-3 [RN]
n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(1-naphthyloxy)tetrahydropyran-3-yl]acetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 676.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.3±3.0 kJ/mol
Flash Point: 362.8±31.5 °C
Index of Refraction: 1.654
Molar Refractivity: 91.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 0.90
ACD/BCF (pH 5.5): 2.85
ACD/KOC (pH 5.5): 73.58
ACD/LogD (pH 7.4): 0.90
ACD/BCF (pH 7.4): 2.85
ACD/KOC (pH 7.4): 73.58
Polar Surface Area: 108 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 68.6±5.0 dyne/cm
Molar Volume: 248.3±5.0 cm3

Click to predict properties on the Chemicalize site


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