ChemSpider 2D Image | 2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({4-[(methylamino)methyl]-1H-1,2,3-triazol-1-yl}methyl)tetrahydro-2-furanyl]-1-(4-morpholinyl)ethanone | C15H25N5O5

2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({4-[(methylamino)methyl]-1H-1,2,3-triazol-1-yl}methyl)tetrahydro-2-furanyl]-1-(4-morpholinyl)ethanone

  • Molecular FormulaC15H25N5O5
  • Average mass355.389 Da
  • Monoisotopic mass355.185577 Da
  • ChemSpider ID21387422

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({4-[(methylamino)methyl]-1H-1,2,3-triazol-1-yl}methyl)tetrahydro-2-furanyl]-1-(4-morpholinyl)ethanon [German] [ACD/IUPAC Name]
2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({4-[(methylamino)methyl]-1H-1,2,3-triazol-1-yl}methyl)tetrahydro-2-furanyl]-1-(4-morpholinyl)ethanone [ACD/IUPAC Name]
2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({4-[(méthylamino)méthyl]-1H-1,2,3-triazol-1-yl}méthyl)tétrahydro-2-furanyl]-1-(4-morpholinyl)éthanone [French] [ACD/IUPAC 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: 640.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 341.2±34.3 °C
Index of Refraction: 1.680
Molar Refractivity: 86.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.24
ACD/LogD (pH 5.5): -3.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 63.6±7.0 dyne/cm
Molar Volume: 228.2±7.0 cm3

Click to predict properties on the Chemicalize site


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