3-Bromonaphthalen-1-amine

Base Information

• Chemical Name: 3-Bromonaphthalen-1-amine
• CAS No.: 90766-34-0
• Molecular Formula: C10H8BrN
• Molecular Weight: 222.084
• Hs Code.: 2921450090
• DSSTox Substance ID: DTXSID20569427
• Wikidata: Q82456579
• Mol file: 90766-34-0.mol

Synonyms:3-bromonaphthalen-1-amine;90766-34-0;1-Amino-3-Bromonaphthalene;3-Bromo-naphthalen-1-ylamine;3-Bromo-1-naphthalenamine;SCHEMBL1429141;DTXSID20569427;AMY42475;MFCD13180525;AKOS022506494;SB39791;AS-58879;CS-0040521;EN300-160095;W17912

Chemical Property of 3-Bromonaphthalen-1-amine

Chemical Property:

• Melting Point: 70 °C
• Boiling Point: 354.4±17.0 °C(Predicted)
• PKA: 2.73±0.10(Predicted)
• PSA: 26.02000
• Density: 1.563±0.06 g/cm3(Predicted)
• LogP: 3.76570
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 220.98401
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

97% ^*data from raw suppliers

3-Bromonaphthalen-1-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(C=C2N)Br

Technology Process of 3-Bromonaphthalen-1-amine

There total 3 articles about 3-Bromonaphthalen-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: 84.0%

3-bromo-1-nitronaphthalene (102153-47-9) → 3-bromonaphthalen-1-amine (90766-34-0)

Guidance literature:

With ammonium chloride; In tetrahydrofuran; ethanol; water; at 75 ℃; for 2h;

Reference yield:

1-amino-4-nitronaphthalene (776-34-1) → 3-bromonaphthalen-1-amine (90766-34-0)

Guidance literature:

Multi-step reaction with 3 steps

1: nitrobenzene; bromine

2: concentrated H₂SO₄; glacial acetic acid / Diazotization_.Erwaermen der Diazoniumsalz-Loesung mit Aethanol

3: tin; aqueous hydrochloric acid

With hydrogenchloride; tin; sulfuric acid; bromine; acetic acid; nitrobenzene;

DOI:10.1039/jr9340001705

Reference yield:

2-bromo-4-nitronaphthalen-1-amine (63240-26-6) → 3-bromonaphthalen-1-amine (90766-34-0)

Guidance literature:

Multi-step reaction with 2 steps

1: concentrated H₂SO₄; glacial acetic acid / Diazotization_.Erwaermen der Diazoniumsalz-Loesung mit Aethanol

2: tin; aqueous hydrochloric acid

With hydrogenchloride; tin; sulfuric acid; acetic acid;

DOI:10.1039/jr9340001705

upstream raw materials:

3-bromo-1-nitronaphthalene

1-amino-4-nitronaphthalene

2-bromo-4-nitronaphthalen-1-amine

Downstream raw materials:

3-bromo-1-hydroxynaphthalene

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