2-Carbamoyl-2-fluoropentanoic acid

Base Information

• Chemical Name: 2-Carbamoyl-2-fluoropentanoic acid
• CAS No.: 18283-35-7
• Molecular Formula: C₆H₁₀FNO₃
• Molecular Weight: 163.149
• NSC Number: 87255
• DSSTox Substance ID: DTXSID60293118
• Mol file: 18283-35-7.mol

Synonyms:18283-35-7;2-carbamoyl-2-fluoropentanoic acid;NSC87255;NCIOpen2_001030;DTXSID60293118;NSC-87255

Chemical Property of 2-Carbamoyl-2-fluoropentanoic acid

Chemical Property:

• Vapor Pressure: 3.48E-06mmHg at 25°C
• Boiling Point: 360.8°Cat760mmHg
• Flash Point: 172°C
• Density: 1.269g/cm³
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 163.06447134
• Heavy Atom Count: 11
• Complexity: 183

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(C(=O)N)(C(=O)O)F

Technology Process of 2-Carbamoyl-2-fluoropentanoic acid

There total 2 articles about 2-Carbamoyl-2-fluoropentanoic 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:

2-Cyano-2-fluoro-pentanoic acid ethyl ester (18283-12-0) → 2-Carbamoyl-2-fluoro-pentanoic acid (18283-35-7)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/jm00316a008

Reference yield:

ethyl 2-cyanopentanoate (6967-47-1) → 2-Carbamoyl-2-fluoro-pentanoic acid (18283-35-7)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) Na, toluene, (ii) ClO₃F

2: aq. NaOH

With sodium hydroxide;

DOI:10.1021/jm00316a008

upstream raw materials:

2-Cyano-2-fluoro-pentanoic acid ethyl ester

ethyl 2-cyanopentanoate