1-Iodo-9h-fluoren-9-one

Base Information

• Chemical Name: 1-Iodo-9h-fluoren-9-one
• CAS No.: 52086-21-2
• Molecular Formula: C13H7 I O
• Molecular Weight: 306.102
• NSC Number: 109624
• DSSTox Substance ID: DTXSID50296496
• Nikkaji Number: J1.820.886E
• Wikidata: Q82037124
• Mol file: 52086-21-2.mol

Synonyms:1-iodo-9h-fluoren-9-one;52086-21-2;1-iodofluoren-9-one;9H-Fluoren-9-one, 1-iodo-;NSC109624;1-Iodo-fluoren-9-one;SCHEMBL9262025;DTXSID50296496;AKOS024337450;NSC-109624

Chemical Property of 1-Iodo-9h-fluoren-9-one

Chemical Property:

• Vapor Pressure: 6.89E-07mmHg at 25°C
• Boiling Point: 408.7°C at 760 mmHg
• Flash Point: 200.9°C
• Density: 1.833g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 305.95416
• Heavy Atom Count: 15
• Complexity: 276

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=C2C(=C1)C3=C(C2=O)C(=CC=C3)I

Technology Process of 1-Iodo-9h-fluoren-9-one

There total 2 articles about 1-Iodo-9h-fluoren-9-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: 77.0%

10-oxodibenziodinium iodide → 9-fluorenone (486-25-9,952573-42-1) + o,o'-diiodobenzophenone (25187-02-4) + 1-iodo-9H-fluoren-9-one (52086-21-2)

Guidance literature:

at 180 ℃; for 0.166667h;

DOI:10.1007/BF00954481

Reference yield: 45.0%

10H-dibenziodinium tetrafluoroboride → ortho-benzyliodobenzene (35444-93-0) + 1-iodo-9H-fluorene (54366-33-5) + 1-iodo-9H-fluoren-9-one (52086-21-2) + 2-iodo-2'-nitrodiphenylmethane (99539-19-2)

Guidance literature:

With sodium nitrite; In water; dimethyl sulfoxide; for 2h; Yields of byproduct given; Heating;

DOI:10.1007/BF00956090

Reference yield: 88.0%

1-iodo-9H-fluoren-9-one (52086-21-2) + phenylacetylene (536-74-3) → 1-(phenylethynyl)-9-fluorenone (158044-55-4)

Guidance literature:

With copper(l) iodide; tetrakis(triphenylphosphine) palladium⁽⁰⁾; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; for 12h; Ambient temperature;

DOI:10.1021/jo982326k

Downstream raw materials:

1-(phenylethynyl)-9-fluorenone

9-(diphenylvinylidene)-1-(phenylethynyl)-9H-fluorene

9--1-(phenylethynyl)-9H-fluorene

C₇₂H₆₆