10-Fluoro-3-methyldecanoic acid

Base Information

• Chemical Name: 10-Fluoro-3-methyldecanoic acid
• CAS No.: 459-82-5
• Molecular Formula: C₁₁H₂₁FO₂
• Molecular Weight: 204.285
• DSSTox Substance ID: DTXSID60963460
• Nikkaji Number: J68.356F
• Mol file: 459-82-5.mol

Synonyms:10-Fluoro-3-methyldecanoic acid;459-82-5;BRN 1770460;DECANOIC ACID, 10-FLUORO-3-METHYL-;4-02-00-01076 (Beilstein Handbook Reference);C11H21FO2;DTXSID60963460;LS-59364

Chemical Property of 10-Fluoro-3-methyldecanoic acid

Chemical Property:

• Vapor Pressure: 0.000223mmHg at 25°C
• Boiling Point: 302.9°C at 760 mmHg
• Flash Point: 137°C
• PSA: 37.30000
• Density: 0.97g/cm³
• LogP: 3.40730
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 204.15255807
• Heavy Atom Count: 14
• Complexity: 148

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCCCCCCF)CC(=O)O

Technology Process of 10-Fluoro-3-methyldecanoic acid

There total 1 articles about 10-Fluoro-3-methyldecanoic 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:

3-methyl-1,5-pentanedioic acid monomethyl ester (27151-65-1) + 7-fluoro-heptanoic acid (334-28-1) → 10-fluoro-3-methyl-decanoic acid (459-82-5)

Guidance literature:

With methanol; sodium; Electrolysis_.und anschliessend Hydrolyse mit wss.Natronlauge;

DOI:10.1021/ja01566a077

Reference yield:

10-fluoro-3-methyl-decanoic acid (459-82-5) → 11-fluoro-4-methyl-undecanoic acid (2839-41-0)

Guidance literature:

Multi-step reaction with 2 steps

1: thionyl chloride

2: diethyl ether / und Erwaermen einer Loesung des Reaktionsprodukts in Dioxan mit Silberoxid, Natriumcarbonat, Natriumthiosulfat und Wasser

With thionyl chloride; diethyl ether;

DOI:10.1021/ja01566a077

upstream raw materials:

3-methyl-1,5-pentanedioic acid monomethyl ester

7-fluoro-heptanoic acid

Downstream raw materials:

11-fluoro-4-methyl-undecanoic acid