(1R,3S,4aS,8aR)-8A-(Hydroxymethyl)Octahydro-1,3,4A(2H)-Naphthalenetriol
[CAS# 498575-31-8]

Identification

• Name: (1R,3S,4aS,8aR)-8A-(Hydroxymethyl)Octahydro-1,3,4A(2H)-Naphthalenetriol
• Synonyms: (1R,3S,4aS,8aR)-8a-(hydroxymethyl)decahydronaphthalene-1,3,4a-triol
• Molecular Formula: C₁₁H₂₀O₄
• Molecular Weight: 216.27
• CAS Registry Number: 498575-31-8
• SMILES: C1CC[C@]2([C@@H](C[C@@H](C[C@]2(C1)O)O)O)CO
• InChI: 1S/C11H20O4/c12-7-10-3-1-2-4-11(10,15)6-8(13)5-9(10)14/h8-9,12-15H,1-7H2/t8-,9+,10+,11-/m0/s1
• InChIKey: NMVNUNBGTDXDFS-ZDCRXTMVSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 409.3±40.0°C at 760 mmHg (Cal.)
• Flash point: 201.7±21.9°C (Cal.)
• Refractive index: 1.615 (Cal.)