ChemSpider 2D Image | (3aS,5S,6R,6aR)-2-Amino-5-(hydroxymethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-6-ol | C6H10N2O4

(3aS,5S,6R,6aR)-2-Amino-5-(hydroxymethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-6-ol

  • Molecular FormulaC6H10N2O4
  • Average mass174.155 Da
  • Monoisotopic mass174.064056 Da
  • ChemSpider ID61684251

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3aS,5S,6R,6aR)-2-Amino-5-(hydroxymethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-6-ol [German] [ACD/IUPAC Name]
(3aS,5S,6R,6aR)-2-Amino-5-(hydroxymethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-6-ol [ACD/IUPAC Name]
(3aS,5S,6R,6aR)-2-Amino-5-(hydroxyméthyl)-3a,5,6,6a-tétrahydrofuro[2,3-d][1,3]oxazol-6-ol [French] [ACD/IUPAC Name]
Furo[2,3-d]oxazole-5-methanol, 2-amino-3a,5,6,6a-tetrahydro-6-hydroxy-, (3aS,5S,6R,6aR)- [ACD/Index Name]
915314-74-8 [RN]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 422.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±6.0 kJ/mol
Flash Point: 209.0±31.5 °C
Index of Refraction: 1.796
Molar Refractivity: 34.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.05
ACD/LogD (pH 5.5): -0.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.46
ACD/LogD (pH 7.4): -0.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.55
Polar Surface Area: 97 Å2
Polarizability: 13.7±0.5 10-24cm3
Surface Tension: 94.7±7.0 dyne/cm
Molar Volume: 81.1±7.0 cm3

Click to predict properties on the Chemicalize site


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