1,3-Trimethylene Thymine Cyclic Tetramer
[CAS# 68675-73-0]

Identification

• Name: 1,3-Trimethylene Thymine Cyclic Tetramer
• Synonyms: 1,3-Trimethylene Thymine Cyclic Tetramer; 1,3-Ttct
• Molecular Formula: C₃₂H₄₀N₈O₈
• Molecular Weight: 664.72
• CAS Registry Number: 68675-73-0
• SMILES: N15C(=O)N(C=C(C1=O)C)CCCN2C(=O)N(C(=O)C(=C2)C)CCCN3C(=O)N(C=C(C3=O)C)CCCN4C(=O)N(C(=O)C(=C4)C)CCC5
• InChI: 1S/C32H40N8O8/c1-21-17-33-9-5-10-34-18-22(2)27(43)39(30(34)46)15-8-16-40-28(44)24(4)20-36(32(40)48)12-6-11-35-19-23(3)26(42)38(31(35)47)14-7-13-37(25(21)41)29(33)45/h17-20H,5-16H2,1-4H3
• InChIKey: ZKCMPSNOGVCLMX-UHFFFAOYSA-N

Properties

• Density: 1.463g/cm³ (Cal.)
• Boiling point: 791.903°C at 760 mmHg (Cal.)
• Flash point: 326.111°C (Cal.)