1H-Indene-1,3(2H)-dione, 2-[(3-chlorophenyl)methylene]-

Base Information

• Chemical Name: 1H-Indene-1,3(2H)-dione, 2-[(3-chlorophenyl)methylene]-
• CAS No.: 15875-55-5
• Molecular Formula: C16H9ClO2
• Molecular Weight: 268.699
• DSSTox Substance ID: DTXSID30354846
• Nikkaji Number: J2.386.798B
• Mol file: 15875-55-5.mol

Synonyms:15875-55-5;1H-Indene-1,3(2H)-dione, 2-[(3-chlorophenyl)methylene]-;CBMicro_005398;SCHEMBL245217;DTXSID30354846;SMSF0003475;AKOS000953894;CB07820;2-(3-Chlorobenzylidene)indan-1,3-dione;BIM-0005365.P001;2-(3-chlorobenzylidene)-1h-indene-1,3(2h)-dione

Chemical Property of 1H-Indene-1,3(2H)-dione, 2-[(3-chlorophenyl)methylene]-

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 268.0291072
• Heavy Atom Count: 19
• Complexity: 401

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=CC=C3)Cl)C2=O

Technology Process of 1H-Indene-1,3(2H)-dione, 2-[(3-chlorophenyl)methylene]-

There total 1 articles about 1H-Indene-1,3(2H)-dione, 2-[(3-chlorophenyl)methylene]- 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%

1H-indene-1,3(2H)-dione (606-23-5) + m-Chlorobenzaldehyde (587-04-2) → 2-(3-chlorobenzylidene)indane-1,3-dione (15875-55-5)

Guidance literature:

With silica gel; at 20 ℃; for 0.25h;

DOI:10.1080/00397910500282968

Reference yield: 95.0%

2-(3-chlorobenzylidene)indane-1,3-dione (15875-55-5) + ethyl 3-oxo-3-phenylpropionate (94-02-0) → C27H19ClO5

Guidance literature:

ethyl 3-oxo-3-phenylpropionate; With di-tert-butyl peroxide;

2-(3-chlorobenzylidene)indane-1,3-dione; With tetra-(n-butyl)ammonium iodide; at 120 ℃; for 0.166667h; Flow reactor;

Reference yield: 95.0%

2-(3-chlorobenzylidene)indane-1,3-dione (15875-55-5) + trifluoroacetic anhydride (407-25-0) → 2-(1-(3-chlorophenyl)-3,3,3-trifluoro-2-oxopropylidene)-1H-indene-1,3(2H)-dione

Guidance literature:

With triethylamine; diphenyl(methyl)phosphine; In tetrahydrofuran; at 30 ℃; for 0.5h; Inert atmosphere;

DOI:10.1039/c7cc03995f

upstream raw materials:

1H-indene-1,3(2H)-dione

m-Chlorobenzaldehyde

Downstream raw materials:

2-[(3-Chloro-phenyl)-(4-hydroxy-2-oxo-2H-thiochromen-3-yl)-methyl]-indan-1,3-dione

2-[(3-Chloro-phenyl)-(4-hydroxy-2-oxo-2H-chromen-3-yl)-methyl]-indan-1,3-dione

C₂₂H₁₁ClN₄O₂

2-[(3-Chloro-phenyl)-phenyl-methyl]-indan-1,3-dione