(5E)-N,N-Diethyl-5-[(2-Octyldecyl)Imino]-5H-Benzo[a]Phenoxazin-9-Amine
[CAS# 149683-18-1]

Identification

• Name: (5E)-N,N-Diethyl-5-[(2-Octyldecyl)Imino]-5H-Benzo[a]Phenoxazin-9-Amine
• Synonyms: 9-(Diethylamino)-5-[(2-octyldecyl)imino]benzo[a]phenoxazine; Chromoionophore III
• Molecular Formula: C₃₈H₅₅N₃O
• Molecular Weight: 569.86
• CAS Registry Number: 149683-18-1
• SMILES: N=1c4c(OC=3C=1c2ccccc2/C(=N/CC(CCCCCCCC)CCCCCCCC)/C=3)cc(cc4)N(CC)CC
• InChI: 1S/C38H55N3O/c1-5-9-11-13-15-17-21-30(22-18-16-14-12-10-6-2)29-39-35-28-37-38(33-24-20-19-23-32(33)35)40-34-26-25-31(27-36(34)42-37)41(7-3)8-4/h19-20,23-28,30H,5-18,21-22,29H2,1-4H3/b39-35+
• InChIKey: ICVAQSQRYBGWQH-IGIMMJHKSA-N

Properties

• Density: 1.031g/cm³ (Cal.)
• Boiling point: 650.271°C at 760 mmHg (Cal.)
• Flash point: 347.071°C (Cal.)
• Refractive index: 1.558 (Cal.)