Nonylphosphonic acid

Base Information

• Chemical Name: Nonylphosphonic acid
• CAS No.: 4730-79-4
• Molecular Formula: C9H21O3P
• Molecular Weight: 208.24
• European Community (EC) Number: 811-105-3
• Nikkaji Number: J265.530F
• Mol file: 4730-79-4.mol

Synonyms:nonylphosphonic acid;4730-79-4;n-Nonylphosphonic acid;Phosphonic acid, nonyl-;Phosphonicacid,nonyl-;Nonane-1-phosphonic acid;SCHEMBL1235052;Nonylphosphonic Acid, >/=98%;MFCD00015842;AKOS017343253;CS-0373912;N1025;T72505

Chemical Property of Nonylphosphonic acid

Chemical Property:

• Melting Point: 102.0 to 106.0 °C
• PSA: 67.34000
• LogP: 2.91470
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 208.12283153
• Heavy Atom Count: 13
• Complexity: 153

Purity/Quality:

95% ^*data from raw suppliers

Nonylphosphonic Acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCP(=O)(O)O

Technology Process of Nonylphosphonic acid

There total 3 articles about Nonylphosphonic 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: 71.0%

1-Bromononane (693-58-3) → n-nonylphosphonic acid (4730-79-4)

Guidance literature:

1-Bromononane; With potassium hydroxide semihydrate; phosphorus; cetyltrimethylammonim bromide; In water; toluene; at 85 - 90 ℃; for 6h; Inert atmosphere;

With nitric acid; In water; at 100 - 110 ℃; for 2h; pH=4; Inert atmosphere;

DOI:10.1002/ejoc.202100067

Reference yield:

nonyl-phosphonic acid dibutyl ester (101791-94-0) → n-nonylphosphonic acid (4730-79-4)

Guidance literature:

With hydrogenchloride;

DOI:10.1021/ja01223a046

Reference yield:

→ n-nonylphosphonic acid (4730-79-4)

Guidance literature:

Nonyliodid, P(gelb)/methanol. NaOH u. Elektrolyse (daneben andere Verb.);

upstream raw materials:

nonyl-phosphonic acid dibutyl ester

1-Bromononane

Refernces