9H-Carbazole, 9-acetyl-3-nitro-

Base Information

• Chemical Name: 9H-Carbazole, 9-acetyl-3-nitro-
• CAS No.: 89672-04-8
• Molecular Formula: C14H10N2O3
• Molecular Weight: 254.245
• DSSTox Substance ID: DTXSID40385742
• Nikkaji Number: J570.231C
• Wikidata: Q82178703
• Mol file: 89672-04-8.mol

Synonyms:9H-Carbazole, 9-acetyl-3-nitro-;89672-04-8;1-(3-nitrocarbazol-9-yl)ethanone;9-acetyl-3-nitro-9H-carbazole;Cambridge id 5354159;Oprea1_048202;SCHEMBL7976945;3-Nitro-9-acetyl-9H-carbazole;DTXSID40385742;STK837750;AKOS003653897;CCG-350370;1-(3-nitro-9H-carbazol-9-yl)ethanone;AB00082489-01;AE-842/33001012;SR-01000206622;SR-01000206622-1

Chemical Property of 9H-Carbazole, 9-acetyl-3-nitro-

Chemical Property:

• PSA: 67.82000
• LogP: 3.88600
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 254.06914219
• Heavy Atom Count: 19
• Complexity: 393

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CC=C31

Technology Process of 9H-Carbazole, 9-acetyl-3-nitro-

There total 1 articles about 9H-Carbazole, 9-acetyl-3-nitro- 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: 63.0%

9-acetylcarbazole (574-39-0) → 1-nitro-9H-carbazole (31438-22-9) + 1-(3-nitrocarbazol-9-yl)ethanone (89672-04-8) + 3,6-dinitro-9H-carbazole (3244-54-0)

Guidance literature:

With ammonium cerium(IV) nitrate; silica gel; In acetonitrile; for 32h; Heating;

DOI:10.1080/00397919408012618

Reference yield: 96.0%

1-(3-nitrocarbazol-9-yl)ethanone (89672-04-8) → 3-Nitro-carbazol (3077-85-8)

Guidance literature:

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In methanol; for 1h; Further Variations:; Solvents; reaction time; Product distribution; Heating;

DOI:10.1081/SCC-120002011

Reference yield:

iodobenzene (591-50-4) + 1-(3-nitrocarbazol-9-yl)ethanone (89672-04-8) → (9-Acetyl-6-nitro-9H-carbazol-3-yl)-phenyl-iodonium; bromide

Guidance literature:

With chromium(VI) oxide; sulfuric acid; acetic anhydride; acetic acid; potassium bromide; Yield given. Multistep reaction;

upstream raw materials:

9-acetylcarbazole

Downstream raw materials:

3-Nitro-carbazol

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