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

(3aR,5R,6S)-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 ID23976789

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(3aR,5R,6S)-2-Amino-5-(hydroxymethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-6-ol [ACD/IUPAC Name]
(3aR,5R,6S)-2-Amino-5-(hydroxymethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]oxazol-6-ol [German] [ACD/IUPAC Name]
(3aR,5R,6S)-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-, (3aR,5R,6S)- [ACD/Index Name]
(3aR,5R,6R,6aS)-2-Amino-5-(hydroxymethyl)-3a,5,6,6a-tetrahydrofuro[2,3-d]oxazol-6-ol
220919-94-8 [RN]
27963-98-0 [RN]
2-Amino-b-D-arabinofurano[1,2;4,5]oxazoline

    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): -1.49
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.01
    ACD/LogD (pH 7.4): -0.93
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 7.30
    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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