4-(7,8,9,10-Tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[b]naphtho[2,3-e][1,4]diazepin-12-yl)-Benzoic acid
[CAS# 172705-89-4]

Identification

• Name: 4-(7,8,9,10-Tetrahydro-5,7,7,10,10-pentamethyl-5H-benzo[b]naphtho[2,3-e][1,4]diazepin-12-yl)-Benzoic acid
• Synonyms: 4-(7,8,9,10-Tetrahydro-5,7,7,10,10-Pentamethyl-5H-Benzo(B)Naphtho(2,3-E)(1,4)Diazepin-12-Yl)Benzoic Acid; Benzoic Acid, 4-(7,8,9,10-Tetrahydro-5,7,7,10,10-Pentamethyl-5H-Benzo(B)Naphtho(2,3-E)(1,4)Diazepin-12-Yl)-; Hx 600
• Molecular Formula: C₂₉H₃₀N₂O₂
• Molecular Weight: 438.57
• CAS Registry Number: 172705-89-4
• SMILES: C1=C5C(=CC2=C1C(=NC3=C(N2C)C=CC=C3)C4=CC=C(C=C4)C(=O)O)C(CCC5(C)C)(C)C
• InChI: 1S/C29H30N2O2/c1-28(2)14-15-29(3,4)22-17-25-20(16-21(22)28)26(18-10-12-19(13-11-18)27(32)33)30-23-8-6-7-9-24(23)31(25)5/h6-13,16-17H,14-15H2,1-5H3,(H,32,33)
• InChIKey: DLFBCHSYAZBTSS-UHFFFAOYSA-N

Properties

• Density: 1.176g/cm³ (Cal.)
• Boiling point: 589.595°C at 760 mmHg (Cal.)
• Flash point: 310.376°C (Cal.)