Ethyl 1H-indene-3-carboxylate

Base Information

• Chemical Name: Ethyl 1H-indene-3-carboxylate
• CAS No.: 51056-37-2
• Molecular Formula: C12H12O2
• Molecular Weight: 188.226
• DSSTox Substance ID: DTXSID40565880
• Nikkaji Number: J2.542.181G
• Wikidata: Q82451201
• Mol file: 51056-37-2.mol

Synonyms:Ethyl 1H-indene-3-carboxylate;51056-37-2;SCHEMBL4018002;DTXSID40565880

Chemical Property of Ethyl 1H-indene-3-carboxylate

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 188.083729621
• Heavy Atom Count: 14
• Complexity: 255

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CCC2=CC=CC=C21

Technology Process of Ethyl 1H-indene-3-carboxylate

There total 3 articles about Ethyl 1H-indene-3-carboxylate 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:

ethanol (64-17-5) + 2-diazo-1,2-naphthoquinone (879-15-2,33670-73-4) → α-naphthol (90-15-3) + ethyl 1H-indene-3-carboxylate (51056-37-2) + 2-methoxy-1-naphthol (1888-41-1)

Guidance literature:

Irradiation;

Reference yield:

ethanol (64-17-5) + 2-diazo-1,2-naphthoquinone (879-15-2,33670-73-4) → α-naphthol (90-15-3) + ethyl 1H-indene-3-carboxylate (51056-37-2) + 2-Ethoxy-1-naphthol (73733-01-4)

Guidance literature:

Product distribution; Mechanism; Irradiation; in the presence of oxygen; thermolysis at 185-190 deg C in a selaed tube, 8 min;

Reference yield:

ethanol (64-17-5) + 1-diazo-2(1H)naphthalenone (773-90-0,860253-14-1) → ethyl 1H-indene-3-carboxylate (51056-37-2) + β-naphthol (135-19-3)

Guidance literature:

Product distribution; Mechanism; Irradiation; in the presence of oxygen; thermolysis at 185-190 deg C in a sealed tube, 8 min;

upstream raw materials:

ethanol

2-diazo-1,2-naphthoquinone

1-diazo-2(1H)naphthalenone

Downstream raw materials:

3-Ethoxycarbonyl-1-retinyliden-inden

1H-indene-3-carboxamide

3H-indene-1-carboxylic acid

Refernces