7-Fluoro-2,3-dihydro-1H-inden-4-ol

Base Information

• Chemical Name: 7-Fluoro-2,3-dihydro-1H-inden-4-ol
• CAS No.: 161178-24-1
• Molecular Formula: C₉H₉FO
• Molecular Weight: 152.168
• Hs Code.: 2907199090
• DSSTox Substance ID: DTXSID90571754
• Nikkaji Number: J1.641.194I
• Wikidata: Q72480098
• Mol file: 161178-24-1.mol

Synonyms:7-Fluoro-2,3-dihydro-1H-inden-4-ol;161178-24-1;1H-Inden-4-ol,7-fluoro-2,3-dihydro-(9CI);7-fluoro-4-indanol;SCHEMBL8432407;DTXSID90571754;MBECZUQIIUUOTN-UHFFFAOYSA-N;MFCD17167331;AKOS015853513;SS-4323;1H-Inden-4-ol, 7-fluoro-2,3-dihydro-;CS-0159289;N14302;A849722;EN300-24794222;J-519246

Chemical Property of 7-Fluoro-2,3-dihydro-1H-inden-4-ol

Chemical Property:

• Boiling Point: 260℃
• Flash Point: 137℃
• PSA: 20.23000
• Density: 1.255
• LogP: 2.02000
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 152.063743068
• Heavy Atom Count: 11
• Complexity: 149

Purity/Quality:

97% ^*data from raw suppliers

7-Fluoro-2,3-dihydro-1H-inden-4-ol >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2=C(C=CC(=C2C1)F)O

Technology Process of 7-Fluoro-2,3-dihydro-1H-inden-4-ol

There total 3 articles about 7-Fluoro-2,3-dihydro-1H-inden-4-ol 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: 82.0%

4-Fluoro-7-hydroxy-indan-1-one (136191-16-7) → 7-fluoro-2,3-dihydro-1H-inden-4-ol (161178-24-1)

Guidance literature:

With triethylsilane; trifluoroacetic acid; at 80 ℃; Inert atmosphere;

Reference yield:

4-Fluorophenol (371-41-5) → 7-fluoro-2,3-dihydro-1H-inden-4-ol (161178-24-1)

Guidance literature:

Multi-step reaction with 3 steps

1: pyridine / dichloromethane / 1 h / 30 °C / Cooling with ice; Inert atmosphere

2: aluminum (III) chloride / 3.25 h / 100 - 180 °C / Inert atmosphere

3: triethylsilane; trifluoroacetic acid / 80 °C / Inert atmosphere

With pyridine; triethylsilane; aluminum (III) chloride; trifluoroacetic acid; In dichloromethane;

Reference yield:

4-fluorophenyl 3-chloropropanoate (127033-12-9) → 7-fluoro-2,3-dihydro-1H-inden-4-ol (161178-24-1)

Guidance literature:

Multi-step reaction with 2 steps

1: aluminum (III) chloride / 3.25 h / 100 - 180 °C / Inert atmosphere

2: triethylsilane; trifluoroacetic acid / 80 °C / Inert atmosphere

With triethylsilane; aluminum (III) chloride; trifluoroacetic acid;

upstream raw materials:

4-Fluorophenol

4-fluorophenyl 3-chloropropanoate

4-Fluoro-7-hydroxy-indan-1-one