2-(9H-Carbazol-9-YL)acetaldehyde

Base Information

• Chemical Name: 2-(9H-Carbazol-9-YL)acetaldehyde
• CAS No.: 25557-77-1
• Molecular Formula: C14H11NO
• Molecular Weight: 209.24300
• DSSTox Substance ID: DTXSID40512793
• Wikidata: Q82372194
• Mol file: 25557-77-1.mol

Synonyms:2-(9H-CARBAZOL-9-YL)ACETALDEHYDE;25557-77-1;2-carbazol-9-ylacetaldehyde;SCHEMBL13456337;(9H-Carbazol-9-yl)acetaldehyde;DTXSID40512793;MFCD09695840;AKOS003654047;NS-02318

Chemical Property of 2-(9H-Carbazol-9-YL)acetaldehyde

Chemical Property:

• PSA: 22.00000
• LogP: 2.99340
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 209.084063974
• Heavy Atom Count: 16
• Complexity: 244

Purity/Quality:

9H-Carbazole-9-acetaldehyde 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2CC=O

Technology Process of 2-(9H-Carbazol-9-YL)acetaldehyde

There total 3 articles about 2-(9H-Carbazol-9-YL)acetaldehyde 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: 60.0%

carbazole-9-acetaldehyde diethylacetal (74914-81-1) → 2-(9H-carbazol-9-yl)acetaldehyde (25557-77-1)

Guidance literature:

With toluene-4-sulfonic acid; In water; acetone; for 4h; Heating;

Reference yield:

9H-carbazole (86-74-8,105184-46-1,97960-57-1) → 2-(9H-carbazol-9-yl)acetaldehyde (25557-77-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 1.) NaH / 1.) dioxane, reflux, 4 h, 2.) dioxane, reflux, overnight

2: 60 percent / p-toluene sulfonic acid / acetone; H₂O / 4 h / Heating

With sodium hydride; toluene-4-sulfonic acid; In water; acetone;

Reference yield:

→ 2-(9H-carbazol-9-yl)acetaldehyde (25557-77-1)

Guidance literature:

1-Carbazol-9-yl-2,3-dihydroxypropan, HIO4, aq.MeOH;

DOI:10.1021/jo00836a024

upstream raw materials:

carbazole-9-acetaldehyde diethylacetal

9H-carbazole

Downstream raw materials:

C₂₈H₃₁N₅O₃