2-Acetylphenyl borodifluoridate

Base Information

• Chemical Name: 2-Acetylphenyl borodifluoridate
• CAS No.: 6808-35-1
• Molecular Formula: C8H7 B F2 O2
• Molecular Weight: 183.9478
• NSC Number: 100663
• DSSTox Substance ID: DTXSID40295216
• Wikidata: Q82035012
• Mol file: 6808-35-1.mol

Synonyms:6808-35-1;2-acetylphenyl borodifluoridate;NSC100663;DTXSID40295216;NSC-100663

Chemical Property of 2-Acetylphenyl borodifluoridate

Chemical Property:

• Vapor Pressure: 0.118mmHg at 25°C
• Boiling Point: 219.6°Cat760mmHg
• Flash Point: 86.6°C
• Density: 1.14g/cm³
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 184.0507160
• Heavy Atom Count: 13
• Complexity: 187

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(OC1=CC=CC=C1C(=O)C)(F)F

Technology Process of 2-Acetylphenyl borodifluoridate

There total 1 articles about 2-Acetylphenyl borodifluoridate 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: 71.0%

o-hydroxyacetophenone (118-93-4,104809-67-8) → CH3COC6H4OBF2 (6808-35-1)

Guidance literature:

With boron trifluoride diethyl etherate; In benzene; at 40 - 50 ℃; for 1h;

DOI:10.1023/A:1013994718545

Reference yield: 59.0%

benzaldehyde (100-52-7) + CH3COC6H4OBF2 (6808-35-1) → C15H11BF2O2

Guidance literature:

With acetic anhydride; at 75 - 80 ℃; for 2h;

DOI:10.1023/A:1013994718545

upstream raw materials:

o-hydroxyacetophenone