3,9-Dibutyl-6-Isopropyl-4,10,12-Trimethyl-1,7,13-Trioxa-4,10,16-Triazacyclooctadecane-2,5,8,11,14,17-Hexone
[CAS# 2503-13-1]

Identification

• Name: 3,9-Dibutyl-6-Isopropyl-4,10,12-Trimethyl-1,7,13-Trioxa-4,10,16-Triazacyclooctadecane-2,5,8,11,14,17-Hexone
• Synonyms: 1,7,13-Trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone, 3,9-dibutyl-4,10,12-trimethyl-6-(1-methylethyl)-; 3,9-Dibutyl-6-isopropyl-4,10,12-trimethyl-1,7,13-trioxa-4,10,16-triazacyclooctadecan-2,5,8,11,14,17-hexon; 3,9-Dibutyl-6-isopropyl-4,10,12-trimethyl-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
• Molecular Formula: C₂₆H₄₃N₃O₉
• Molecular Weight: 541.63
• CAS Registry Number: 2503-13-1
• SMILES: CCCCC1C(=O)OC(C(=O)N(C(C(=O)OCC(=O)NCC(=O)OC(C(=O)N1C)C)CCCC)C)C(C)C
• InChI: 1S/C26H43N3O9/c1-8-10-12-18-25(34)36-15-20(30)27-14-21(31)37-17(5)23(32)28(6)19(13-11-9-2)26(35)38-22(16(3)4)24(33)29(18)7/h16-19,22H,8-15H2,1-7H3,(H,27,30)
• InChIKey: YONVHLOZDKQOBR-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 847.3±65.0°C at 760 mmHg (Cal.)
• Flash point: 466.2±34.3°C (Cal.)
• Refractive index: 1.456 (Cal.)