5,17-Dibromo-25,27-dipropoxycalix[4]arene
[CAS# 176098-88-7]

Identification

• Name: 5,17-Dibromo-25,27-dipropoxycalix[4]arene
• Molecular Formula: C₃₄H₃₄Br₂O₄
• Molecular Weight: 666.45
• CAS Registry Number: 176098-88-7
• SMILES: C(OC4=C5CC1=C(O)C(=CC(=C1)Br)CC2=CC=CC(=C2OCCC)CC3=CC(=CC(=C3O)CC4=CC=C5)Br)CC
• InChI: 1S/C34H34Br2O4/c1-3-11-39-33-21-7-5-8-22(33)14-26-18-30(36)20-28(32(26)38)16-24-10-6-9-23(34(24)40-12-4-2)15-27-19-29(35)17-25(13-21)31(27)37/h5-10,17-20,37-38H,3-4,11-16H2,1-2H3
• InChIKey: NHTBSNJGOLUDGT-UHFFFAOYSA-N

Properties

• Density: 1.402g/cm³ (Cal.)
• Boiling point: 728.448°C at 760 mmHg (Cal.)
• Flash point: 394.351°C (Cal.)