ChemSpider 2D Image | 1-Amino-1-deoxy-D-fructofuranose | C6H13NO5

1-Amino-1-deoxy-D-fructofuranose

  • Molecular FormulaC6H13NO5
  • Average mass179.171 Da
  • Monoisotopic mass179.079376 Da
  • ChemSpider ID28473924

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

1-Amino-1-deoxy-D-fructofuranose [ACD/IUPAC Name]
1-Amino-1-desoxy-D-fructofuranose [German] [ACD/IUPAC Name]
1-Amino-1-désoxy-D-fructofuranose [French] [ACD/IUPAC Name]
51296-39-0 [RN]
D-Fructofuranose, 1-amino-1-deoxy- [ACD/Index Name]
(3S,4S,5R)-2-(Aminomethyl)-5-(hydroxymethyl)tetrahydrofuran-2,3,4-triol
1201794-86-6 [RN]
2089601-30-7 [RN]
QB-2761

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

CCRIS 4693 [DBID]
  • Miscellaneous

    • Appearance:

      Not Available Novochemy [NC-13326]

    • Safety:

      20/21/22 Novochemy [NC-13326]
      20/21/36/37/39 Novochemy [NC-13326]
      GHS07; GHS09 Novochemy [NC-13326]
      H304; H332 Novochemy [NC-13326]
      P332+P313; P305+P351+P338 Novochemy [NC-13326]
      R22 Novochemy [NC-13326]
      Warning Novochemy [NC-13326]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 412.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±6.0 kJ/mol
Flash Point: 203.3±28.7 °C
Index of Refraction: 1.614
Molar Refractivity: 39.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.46
ACD/LogD (pH 5.5): -5.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 116 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 87.3±3.0 dyne/cm
Molar Volume: 112.5±3.0 cm3

Click to predict properties on the Chemicalize site


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