(2R,3R,11R,12R)-1,4,7,10,13,16-Hexaoxacyclooctadecane-2,3,11,12-Tetracarboxylic Acid
[CAS# 119719-58-3]

Identification

• Name: (2R,3R,11R,12R)-1,4,7,10,13,16-Hexaoxacyclooctadecane-2,3,11,12-Tetracarboxylic Acid
• Synonyms: ()-(18-Crown-6)-2,3,11,12-Tetracarboxylic Acid; (2R,3R,11R,12R)-1,4,7,10,13,16-Hexaoxacyclooctadecane-2,3,11,12-Tetracarboxylicacid; 442666_Aldrich
• Molecular Formula: C₁₆H₂₄O₁₄
• Molecular Weight: 440.36
• CAS Registry Number: 119719-58-3
• SMILES: [C@H]1(OCCOCCO[C@H]([C@@H](OCCOCCO[C@H]1C(=O)O)C(=O)O)C(=O)O)C(=O)O
• InChI: 1S/C16H24O14/c17-13(18)9-10(14(19)20)29-7-3-26-4-8-30-12(16(23)24)11(15(21)22)28-6-2-25-1-5-27-9/h9-12H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)/t9-,10-,11-,12-/m1/s1
• InChIKey: FZERLKNAJSFDSQ-DDHJBXDOSA-N

Properties

• Density: 1.4g/cm³ (Cal.)
• Boiling point: 798.884°C at 760 mmHg (Cal.)
• Flash point: 283.652°C (Cal.)

References

• (1): Eunjung Bang, Jin-Won Jung, Wonjae Lee, Dai Woon Lee and Weontae Lee. Chiral recognition of (18-crown-6)-tetracarboxylic acid as a chiral selector determined by NMR spectroscopy, J. Chem. Soc., Perkin Trans. 2, 2001, 0, 1685.