1,2,3,4,5,6-Hexakis-O-(3-Pyridinylcarbonyl)-D-Mannitol
[CAS# 15596-27-7]

Identification

• Name: 1,2,3,4,5,6-Hexakis-O-(3-Pyridinylcarbonyl)-D-Mannitol
• Synonyms: D-mannitol hexanicotinate
• Molecular Formula: C₄₂H₃₂N₆O₁₂
• Molecular Weight: 812.74
• CAS Registry Number: 15596-27-7
• EINECS: 239-676-9
• SMILES: O=C(O[C@H](COC(=O)c1cccnc1)[C@@H](OC(=O)c2cccnc2)[C@H](OC(=O)c3cccnc3)[C@@H](COC(=O)c4cccnc4)OC(=O)c5cccnc5)c6cccnc6
• InChI: 1S/C42H32N6O12/c49-37(27-7-1-13-43-19-27)55-25-33(57-39(51)29-9-3-15-45-21-29)35(59-41(53)31-11-5-17-47-23-31)36(60-42(54)32-12-6-18-48-24-32)34(58-40(52)30-10-4-16-46-22-30)26-56-38(50)28-8-2-14-44-20-28/h1-24,33-36H,25-26H2/t33-,34-,35-,36-/m1/s1
• InChIKey: IMRLNFKFNFLWQF-MGXDLYCJSA-N

Properties

• Density: 1.396g/cm³ (Cal.)
• Boiling point: 965.488°C at 760 mmHg (Cal.)
• Flash point: 537.708°C (Cal.)
• Refractive index: 1.626 (Cal.)