N-(4-Bromophenyl)phthalimide

Base Information

• Chemical Name: N-(4-Bromophenyl)phthalimide
• CAS No.: 40101-31-3
• Molecular Formula: C14H8BrNO2
• Molecular Weight: 302.127
• Hs Code.: 2925190090
• European Community (EC) Number: 678-166-4
• NSC Number: 406153
• UNII: Q5563GUU8L
• DSSTox Substance ID: DTXSID80193146
• Nikkaji Number: J50.514E
• Mol file: 40101-31-3.mol

Synonyms:N-(4-Bromophenyl)phthalimide;40101-31-3;2-(4-bromophenyl)isoindoline-1,3-dione;2-(4-Bromophenyl)isoindole-1,3-dione;Phthalimide, N-(p-bromophenyl)-;N-(p-Bromophenyl)phthalimide;N-p-Bromophenylphthalimide;NSC 406153;1H-Isoindole-1,3(2H)-dione, 2-(4-bromophenyl)-;BRN 0189461;AI3-01400;Q5563GUU8L;2-(4-bromophenyl)-1H-isoindole-1,3(2H)-dione;NSC-406153;5-21-10-00294 (Beilstein Handbook Reference);NSC406153;UNII-Q5563GUU8L;N-(4-bromophenyl)-phthalimide;SCHEMBL3619832;Phthalimide,N-(p-bromophenyl)-;2-(4-bromophenyl)-2,3-dihydro-1H-isoindole-1,3-dione;DNQCPYWSXMATIN-UHFFFAOYSA-;DTXSID80193146;Phthalimide, N-(p-bromo-phenyl)-;MFCD00047301;STK266230;AKOS000175151;SB64095;1H-Isoindole-1, 2-(4-bromophenyl)-;AS-63649;LS-109445;B2707;CS-0182188;FT-0740068;D88952;(4-BOC-AMINO-PIPERIDIN-1-YL)-PYRIDIN-3-YL-ACETICACID

Chemical Property of N-(4-Bromophenyl)phthalimide

Chemical Property:

• Vapor Pressure: 2.85E-08mmHg at 25°C
• Melting Point: 206oC
• Refractive Index: 1.6320 (estimate)
• Boiling Point: 449.5°Cat760mmHg
• PKA: -1.41±0.20(Predicted)
• Flash Point: 225.6°C
• PSA: 37.38000
• Density: 1.651g/cm³
• LogP: 3.31470
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 300.97384
• Heavy Atom Count: 18
• Complexity: 339

Purity/Quality:

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

N-(4-Bromophenyl)phthalimide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)Br

Technology Process of N-(4-Bromophenyl)phthalimide

There total 33 articles about N-(4-Bromophenyl)phthalimide 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: 96.0%

phthalic anhydride (85-44-9) + 4-bromo-aniline (106-40-1) → 2-(4-bromophenyl)isoindoline-1,3-dione (40101-31-3)

Guidance literature:

With N,N-dimethyl-formamide; for 0.00416667h; microwave irradiation;

Reference yield: 91.0%

phthalic anhydride (85-44-9) + 4-bromophenyl isocyanate (2493-02-9) → 2-(4-bromophenyl)isoindoline-1,3-dione (40101-31-3)

Guidance literature:

In N,N-dimethyl acetamide; for 0.05h;

Reference yield: 90.0%

carbon monoxide (201230-82-2) + 2-iodo N-(4-bromophenyl)benzamide (313268-47-2) → 2-(4-bromophenyl)isoindoline-1,3-dione (40101-31-3)

Guidance literature:

With 1,4-diaza-bicyclo[2.2.2]octane; In toluene; at 110 ℃; for 26h;

DOI:10.1002/adsc.201500642

upstream raw materials:

phthalic anhydride

4-bromo-aniline

2-((4-Bromophenyl)amino)isoindoline-1,3-dione

4-bromophenyl isocyanate

Downstream raw materials:

4-Bromo-2-nitroaniline

4-bromo-3-nitroaniline

Ir(5,10,15,20-tetra-p-tolylporphyrinate)(C₆H₄(C₈H₄NO₂))

N-phenyl benzoyl amide