1-Phenyl-9H-beta-carbolin-8-amine

Base Information

• Chemical Name: 1-Phenyl-9H-beta-carbolin-8-amine
• CAS No.: 127042-80-2
• Molecular Formula: C17H13N3
• Molecular Weight: 259.31
• DSSTox Substance ID: DTXSID50561510
• Wikidata: Q82445354
• Mol file: 127042-80-2.mol

Synonyms:127042-80-2;1-Phenyl-9H-beta-carbolin-8-amine;DTXSID50561510

Chemical Property of 1-Phenyl-9H-beta-carbolin-8-amine

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 259.110947427
• Heavy Atom Count: 20
• Complexity: 339

Purity/Quality:

85.0-99.8% ^*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=NC=CC3=C2NC4=C3C=CC=C4N

Technology Process of 1-Phenyl-9H-beta-carbolin-8-amine

There total 2 articles about 1-Phenyl-9H-beta-carbolin-8-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: 69.0%

8-nitro-1-phenyl-9H-pyrido<3,4-b>indole (24243-45-6) → 8-amino-1-phenyl-9H-pyrido<3,4-b>indole (127042-80-2)

Guidance literature:

With hydrogen; nickel; In ethanol; under 1838.8 Torr;

Reference yield:

1-phenyl-9H-pyrido[3,4-b]indole (16765-79-0) → 8-amino-1-phenyl-9H-pyrido<3,4-b>indole (127042-80-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 35 percent / conc. HNO₃, gl. acetic acid / acetic acid / 8 h / Heating

2: 69 percent / H₂ / Raney nickel / ethanol / 1838.8 Torr

With hydrogen; nitric acid; acetic acid; nickel; In ethanol; acetic acid;

Reference yield: 100.0%

acetic anhydride (108-24-7) + 8-amino-1-phenyl-9H-pyrido<3,4-b>indole (127042-80-2) → 8-acetamido-1-phenyl-9H-pyrido<3,4-b>indole (127042-85-7)

Guidance literature:

at 100 ℃; for 1h;

upstream raw materials:

8-nitro-1-phenyl-9H-pyrido<3,4-b>indole

1-phenyl-9H-pyrido[3,4-b]indole

Downstream raw materials:

(1-Phenyl-9H-β-carbolin-8-yl)-carbamic acid ethyl ester

8-acetamido-1-phenyl-9H-pyrido<3,4-b>indole

2-Chloro-N-(1-phenyl-9H-β-carbolin-8-yl)-acetamide

8-(2,4-dinitrophenylamino)-1-phenyl-9H-pyrido<3,4-b>indole