4-Phenylnaphthalen-1-amine

Base Information

• Chemical Name: 4-Phenylnaphthalen-1-amine
• CAS No.: 87833-80-5
• Molecular Formula: C16H13N
• Molecular Weight: 219.286
• DSSTox Substance ID: DTXSID70517751
• Wikidata: Q82379919
• Mol file: 87833-80-5.mol

Synonyms:4-phenylnaphthalen-1-amine;87833-80-5;1-Naphthalenamine, 4-phenyl-;Phenyl-p-naphthylamin;SCHEMBL2208987;DTXSID70517751;HPNTZCAYLSSXRP-UHFFFAOYSA-N;FT-0747465

Chemical Property of 4-Phenylnaphthalen-1-amine

Chemical Property:

• Melting Point: 73-74 °C
• Boiling Point: 140-146 °C(Press: 14 Torr)
• PKA: 3.99±0.10(Predicted)
• PSA: 26.02000
• Density: 1.147±0.06 g/cm3(Predicted)
• LogP: 4.67020
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 219.104799419
• Heavy Atom Count: 17
• Complexity: 244

Purity/Quality:

98%+ ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C3=CC=CC=C32)N

Technology Process of 4-Phenylnaphthalen-1-amine

There total 7 articles about 4-Phenylnaphthalen-1-amine 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: 82.0%

1-azidonaphthalene (6921-40-0) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → 1-amino-4-phenylnaphthalene (87833-80-5)

Guidance literature:

With trifluorormethanesulfonic acid; Ambient temperature;

DOI:10.1039/c39830000447

Reference yield: 73.0%

4-Bromo-1-naphthylamine (2298-07-9) + phenylboronic acid (98-80-6) → 1-amino-4-phenylnaphthalene (87833-80-5)

Guidance literature:

With potassium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In water; toluene; at 100 ℃; for 12h;

Reference yield: 15.0%

1-Nitronaphthalene (86-57-7) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → phenyl-α-naphthylamine (23645-37-6) + 1-amino-4-phenylnaphthalene (87833-80-5) + 3,4-diphenyl-1-naphthylamine

Guidance literature:

With trifluorormethanesulfonic acid; at 0 - 5 ℃; for 2h; Product distribution;

DOI:10.1016/S0040-4039(00)99874-5

upstream raw materials:

1-nitro-4-phenyl-naphthalene

1-azidonaphthalene

benzene

1-Nitronaphthalene

Downstream raw materials:

5-phenyl-1H-benz[g]indole-2,3-dione

4-phenyl-1-naphthol

4-phenyl-naphthalene-1,2-diyldiamine

N-(biphenyl-4-yl)-4-phenylnaphthalen-1-amine

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