10-(4-Bromophenyl)-10H-phenoxazine

Base Information

• Chemical Name: 10-(4-Bromophenyl)-10H-phenoxazine
• CAS No.: 71041-21-9
• Molecular Formula: C18H12BrNO
• Molecular Weight: 338.203
• DSSTox Substance ID: DTXSID20533744
• Nikkaji Number: J3.260.858B
• Wikidata: Q82407179
• Mol file: 71041-21-9.mol

Synonyms:10-(4-BROMOPHENYL)-10H-PHENOXAZINE;71041-21-9;10H-Phenoxazine, 10-(4-bromophenyl)-;10-(4-BROMOPHENYL)PHENOXAZINE;starbld0019001;SCHEMBL15472193;DTXSID20533744;10-(4-Bromo-phenyl)-10H-phenoxazine;10H-Phenoxazine,10-(4-bromophenyl)-;AS-81892;E85529;A934161

Chemical Property of 10-(4-Bromophenyl)-10H-phenoxazine

Chemical Property:

• Melting Point: 196.5-197.9 °C
• Boiling Point: 437.9±34.0 °C(Predicted)
• PKA: -3.16±0.20(Predicted)
• PSA: 12.47000
• Density: 1.479±0.06 g/cm3(Predicted)
• LogP: 6.08960
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 337.01023
• Heavy Atom Count: 21
• Complexity: 333

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N(C3=CC=CC=C3O2)C4=CC=C(C=C4)Br

Technology Process of 10-(4-Bromophenyl)-10H-phenoxazine

There total 6 articles about 10-(4-Bromophenyl)-10H-phenoxazine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 81.0%

phenoxazine (135-67-1) + 1,4-bromoiodobenzene (589-87-7) → 10-(4-Bromophenyl)-10H-phenoxazine (71041-21-9)

Guidance literature:

With tris(dibenzylideneacetone)dipalladium⁽⁰⁾ chloroform complex; johnphos; sodium t-butanolate; In toluene; at 60 ℃; for 11h; Inert atmosphere;

DOI:10.1039/c5tc01380a

Reference yield: 81.0%

1,4-bromoiodobenzene (589-87-7) + 2-[N-(2-chlorophenyl)amino]phenol → 10-(4-Bromophenyl)-10H-phenoxazine (71041-21-9)

Guidance literature:

With copper(l) iodide; caesium carbonate; at 65 - 110 ℃; for 24h; Schlenk technique; Inert atmosphere;

DOI:10.1039/c4ra09593f

Reference yield: 68.0%

→ 10-(4-Bromophenyl)-10H-phenoxazine (71041-21-9)

Guidance literature:

With copper; In N,N-dimethyl-formamide; at 160 ℃; for 48h; Inert atmosphere;

upstream raw materials:

10-phenyl-10H-phenoxazine

phenoxazine

1,4-bromoiodobenzene

1.4-dibromobenzene

Downstream raw materials:

4-(10H-phenoxazin-10-yl)benzoic acid

C₂₆H₁₆N₂O₃S

5-(4-(10H-phenoxazin-10-yl)phenyl)thiophene-2-carbaldehyde

10-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-10H-phenoxazine