6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one

Base Information

• Chemical Name: 6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one
• CAS No.: 41734-98-9
• Molecular Formula: C12H10FNO
• Molecular Weight: 203.216
• European Community (EC) Number: 822-797-1
• Nikkaji Number: J2.707.611D
• Wikidata: Q107966896
• Mol file: 41734-98-9.mol

Synonyms:6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one;41734-98-9;6-fluoro-2,3,4,9-tetrahydrocarbazol-1-one;MFCD00459397;Oprea1_082641;Oprea1_609779;CBDivE_004253;SCHEMBL4234216;BBL012288;STK737663;AKOS000531157;VS-03259;CS-0214671;E89231;EN300-186548;AE-473/30363002;SR-01000457496;SR-01000457496-1;F0905-1086;Z1259157514

Chemical Property of 6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one

Chemical Property:

• PSA: 32.86000
• LogP: 2.82600
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 203.074642105
• Heavy Atom Count: 15
• Complexity: 281

Purity/Quality:

99%, ^*data from raw suppliers

6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2=C(C(=O)C1)NC3=C2C=C(C=C3)F

Technology Process of 6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one

There total 1 articles about 6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one 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: 91.0%

4-fluorophenyhydrazine hydrochloride (823-85-8) + 2-aminocyclohexanone hydrochloride (6946-05-0) → 6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (41734-98-9)

Guidance literature:

4-fluorophenyhydrazine hydrochloride; 2-aminocyclohexanone hydrochloride; With sodium hydroxide; water; at 20 ℃; for 0.25h;

With water; acetic acid; for 5h; Reflux;

DOI:10.1080/00397910802499567

Reference yield: 89.0%

6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (41734-98-9) + benzyl chloride (100-44-7) → 9-benzyl-6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (869194-34-3)

Guidance literature:

With sodium hydroxide; tetrabutylammomium bromide; In tetrahydrofuran; at 50 ℃; for 22h;

DOI:10.1021/jo051146p

Reference yield: 30.0%

6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one (41734-98-9) → 6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-amine (1429901-83-6)

Guidance literature:

With ammonium acetate; sodium cyanoborohydride; In methanol; at 60 ℃;

upstream raw materials:

4-fluorophenyhydrazine hydrochloride

2-aminocyclohexanone hydrochloride

Downstream raw materials:

[6-Fluoro-2,3,4,9-tetrahydro-carbazol-(1E)-ylidene]-phenethyl-amine

9-benzyl-6-fluoro-2,3,4,9-tetrahydro-1H-carbazol-1-one

2-benzyl-7-fluoro-1,2,3,4,5,10-hexahydro-azepino[3,4-b]indole

(7-fluoro-3,4,5,10-tetrahydro-1H-azepino[3,4-b]indol-2-yl)-phenyl-methanone

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