(3R,4R,5S)-5-(Hydroxymethyl)-3,4-Piperidinediol
[CAS# 202979-51-9]

Identification

• Name: (3R,4R,5S)-5-(Hydroxymethyl)-3,4-Piperidinediol
• Synonyms: (3R,4R,5S)-5-(Hydroxymethyl)piperidine-3,4-diol; 5-epi-Isofagomine
• Molecular Formula: C₆H₁₃NO₃
• Molecular Weight: 147.17
• CAS Registry Number: 202979-51-9
• SMILES: C1[C@H]([C@H]([C@@H](CN1)O)O)CO
• InChI: 1S/C6H13NO3/c8-3-4-1-7-2-5(9)6(4)10/h4-10H,1-3H2/t4-,5+,6+/m0/s1
• InChIKey: QPYJXFZUIJOGNX-KVQBGUIXSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 317.2±37.0°C at 760 mmHg (Cal.)
• Flash point: 171.8±17.1°C (Cal.)
• Refractive index: 1.535 (Cal.)

References

• (1): Y. Suman Reddy, Pavan K. Kancharla, Rashmi Roy and Yashwant D. Vankar. Aza-Claisen rearrangement of 2-C-hydroxymethyl glycals as a versatile strategy towards synthesis of isofagomine and related biologically important azasugars, Org. Biomol. Chem., 2012, 10, 2760.