2-Hydroxy-2-phenylindan-1,3-dione

Base Information

• Chemical Name: 2-Hydroxy-2-phenylindan-1,3-dione
• CAS No.: 3761-46-4
• Molecular Formula: C₁₅H₁₀O₃
• Molecular Weight: 238.243
• DSSTox Substance ID: DTXSID101267105
• Nikkaji Number: J2.731.981E
• Mol file: 3761-46-4.mol

Synonyms:2-Hydroxy-2-phenylindan-1,3-dione;3761-46-4;2-Hydroxy-2-phenyl-1H-indene-1,3(2H)-dione;DTXSID101267105

Chemical Property of 2-Hydroxy-2-phenylindan-1,3-dione

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 238.062994177
• Heavy Atom Count: 18
• Complexity: 344

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2(C(=O)C3=CC=CC=C3C2=O)O

Technology Process of 2-Hydroxy-2-phenylindan-1,3-dione

There total 12 articles about 2-Hydroxy-2-phenylindan-1,3-dione 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: 97.9%

phenindione (83-12-5) → 2-hydroxy-2-phenyl-2H-indene-1,3-dione (3761-46-4)

Guidance literature:

With dihydrogen peroxide; sodium hydrogencarbonate; In water; acetonitrile;

DOI:10.1002/jps.22021

Reference yield: 55.0%

indan-1,2,3-trione hydrate (485-47-2) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → 2-hydroxy-2-phenyl-2H-indene-1,3-dione (3761-46-4) + 2,2-diphenyl-1,3-indanedione (23717-59-1)

Guidance literature:

With sulfuric acid; for 1h; Ambient temperature;

DOI:10.1080/00397919808007017

Reference yield:

2-bromo-2-phenyl-indan-1,3-dione (1801-20-3) → 2-hydroxy-2-phenyl-2H-indene-1,3-dione (3761-46-4)

Guidance literature:

With ethanol; silver nitrate;

upstream raw materials:

2-bromo-2-phenyl-indan-1,3-dione

3-bromo-3(α-bromobenzyl)izobenzofuran-1(3H)-one

(α-bromo-benzylidene)-phthalide

indan-1,2,3-trione hydrate

Downstream raw materials:

3-benzoylisobenzofuran-1(3H)-one

α,α'-dioxo-bibenzyl-2-carboxylic acid