Benzamide, 3-fluoro-N-2-propenyl-

Base Information

• Chemical Name: Benzamide, 3-fluoro-N-2-propenyl-
• CAS No.: 88229-23-6
• Molecular Formula: C10H10FNO
• Molecular Weight: 179.194
• DSSTox Substance ID: DTXSID90403389
• Wikidata: Q82207043
• Mol file: 88229-23-6.mol

Synonyms:Benzamide, 3-fluoro-N-2-propenyl-;88229-23-6;DTXSID90403389;AKOS002945140

Chemical Property of Benzamide, 3-fluoro-N-2-propenyl-

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 179.074642105
• Heavy Atom Count: 13
• Complexity: 193

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCNC(=O)C1=CC(=CC=C1)F

Technology Process of Benzamide, 3-fluoro-N-2-propenyl-

There total 1 articles about Benzamide, 3-fluoro-N-2-propenyl- 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: 78.0%

1-amino-2-propene (107-11-9,30551-89-4) + 3-fluorobenzoyl chloride (1711-07-5) → N-Allyl-3-fluoro-benzamide (88229-23-6)

Guidance literature:

In benzene; for 18h;

DOI:10.1021/je00036a040

Reference yield: 70.0%

N-Allyl-3-fluoro-benzamide (88229-23-6) + isopropyl alcohol (67-63-0,8013-70-5) → 3-fluoro-N-(4-hydroxy-4-methylpentyl)benzamide

Guidance literature:

With di-tert-butyl peroxide; at 120 ℃; for 5h; Schlenk technique; Inert atmosphere; Sealed tube;

DOI:10.1021/acs.orglett.5b00088

Reference yield:

N-Allyl-3-fluoro-benzamide (88229-23-6) → 3-fluorobenzamide (455-37-8)

Guidance literature:

With potassium metaperiodate; [{Ru(η³:η³-C10H16)(μ-Cl)Cl}2]; In water; at 100 ℃; for 3h;

DOI:10.1002/chem.200700477

upstream raw materials:

1-amino-2-propene

3-fluorobenzoyl chloride

Downstream raw materials:

3-fluorobenzamide