ChemSpider 2D Image | 4-{[(3R)-3-(Hydroxymethyl)-4-morpholinyl]sulfonyl}-2-nitrophenol | C11H14N2O7S

4-{[(3R)-3-(Hydroxymethyl)-4-morpholinyl]sulfonyl}-2-nitrophenol

  • Molecular FormulaC11H14N2O7S
  • Average mass318.303 Da
  • Monoisotopic mass318.052185 Da
  • ChemSpider ID71034093

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-Morpholinemethanol, 4-[(4-hydroxy-3-nitrophenyl)sulfonyl]-, (3R)- [ACD/Index Name]
4-{[(3R)-3-(Hydroxymethyl)-4-morpholinyl]sulfonyl}-2-nitrophenol [German] [ACD/IUPAC Name]
4-{[(3R)-3-(Hydroxymethyl)-4-morpholinyl]sulfonyl}-2-nitrophenol [ACD/IUPAC Name]
4-{[(3R)-3-(Hydroxyméthyl)-4-morpholinyl]sulfonyl}-2-nitrophénol [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: 522.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 269.5±32.9 °C
Index of Refraction: 1.615
Molar Refractivity: 71.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 1.32
ACD/KOC (pH 5.5): 32.68
ACD/LogD (pH 7.4): -1.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability: 28.3±0.5 10-24cm3
Surface Tension: 68.2±3.0 dyne/cm
Molar Volume: 204.7±3.0 cm3

Click to predict properties on the Chemicalize site


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