3-hydroxy-2,3-dihydro-1H-indene-4-carboxylic Acid

Base Information

• Chemical Name: 3-hydroxy-2,3-dihydro-1H-indene-4-carboxylic Acid
• CAS No.: 77635-15-5
• Molecular Formula: C10H10O3
• DSSTox Substance ID: DTXSID90452519
• Mol file: 77635-15-5.mol

Synonyms:3-hydroxy-2,3-dihydro-1H-indene-4-carboxylic Acid;77635-15-5;3-Hydroxy-2,3-dihydro-1H-indene-4-carboxylicacid;DTXSID90452519;3-hydroxy-4-indanecarboxylic acid;3-hydroxyindane-4-carboxylic acid;SB84934;CS-0270579;EN300-2593421;1H-Indene-4-carboxylic acid, 2,3-dihydro-3-hydroxy-

Chemical Property of 3-hydroxy-2,3-dihydro-1H-indene-4-carboxylic Acid

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 178.062994177
• Heavy Atom Count: 13
• Complexity: 214

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2=C(C1O)C(=CC=C2)C(=O)O

Technology Process of 3-hydroxy-2,3-dihydro-1H-indene-4-carboxylic Acid

There total 1 articles about 3-hydroxy-2,3-dihydro-1H-indene-4-carboxylic Acid 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: 51.0%

Lithium salt of 1-indanol-7-carboxylic acid (77635-14-4) → 1-Indene-7-carboxylic acid (77635-16-6) + 1-Indanol-7-carboxylic acid (77635-15-5)

Guidance literature:

With hydrogenchloride; ice-water bath;

DOI:10.1055/s-1981-29337

Reference yield: 90.0%

1-Indanol-7-carboxylic acid (77635-15-5) → 2,3-dihydro-1H-indene-4-carboxylic acid (4044-54-6)

Guidance literature:

With hydrogen; palladium on activated charcoal; In acetic acid; for 6h;

DOI:10.1016/S0040-4020(97)10068-0

Reference yield:

1-Indanol-7-carboxylic acid (77635-15-5) → indan-4-yl-phenyl ketone (5385-28-4)

Guidance literature:

Multi-step reaction with 5 steps

1: 90 percent / H₂ / Pd/C / acetic acid / 6 h

2: 90 percent / LiAlH₄ / tetrahydrofuran / 2 h / Heating

3: 93 percent / MnO₂ / CH₂Cl₂ / 10 h / Heating

4: 1.) n-BuLi / 1.) THF, -78 deg C, 30 min, 2.) THF, -78 deg C, 30 min; room temperature, 1 h

5: MnO₂ / CH₂Cl₂ / 10 h / Heating

With manganese(IV) oxide; lithium aluminium tetrahydride; n-butyllithium; hydrogen; palladium on activated charcoal; In tetrahydrofuran; dichloromethane; acetic acid;

DOI:10.1016/S0040-4020(97)10068-0

upstream raw materials:

Lithium salt of 1-indanol-7-carboxylic acid

Downstream raw materials:

2,3-dihydro-1H-indene-4-carboxylic acid

indan-4-yl-phenyl ketone

(+/-)-Hydroxy-phenyl-(indanyl-⁽⁴⁾)-methan