Diisobutyl hydrogen phosphate

Base Information

• Chemical Name: Diisobutyl hydrogen phosphate
• CAS No.: 6303-30-6
• Molecular Formula: C8H19O4P
• Molecular Weight: 210.21
• European Community (EC) Number: 228-602-0
• NSC Number: 41918
• UNII: Z27SZH4QDN
• DSSTox Substance ID: DTXSID30212316
• Nikkaji Number: J206.882F
• Wikidata: Q83087395
• Mol file: 6303-30-6.mol

Synonyms:Diisobutyl hydrogen phosphate;6303-30-6;bis(2-methylpropyl) hydrogen phosphate;Phosphoric acid, bis(2-methylpropyl) ester;EINECS 228-602-0;NSC-41918;BIS(2-METHYLPROPOXY)PHOSPHINIC ACID;diisobutylphosphate;NSC41918;starbld0021042;di-isobutylphosphoric acid;Z27SZH4QDN;SCHEMBL269622;DTXSID30212316;NSC 41918;AKOS030240773

Chemical Property of Diisobutyl hydrogen phosphate

Chemical Property:

• Vapor Pressure: 0.00299mmHg at 25°C
• Boiling Point: 263.6°Cat760mmHg
• Flash Point: 113.2°C
• Density: 1.074g/cm³
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 210.10209608
• Heavy Atom Count: 13
• Complexity: 163

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)COP(=O)(O)OCC(C)C

Technology Process of Diisobutyl hydrogen phosphate

There total 10 articles about Diisobutyl hydrogen phosphate 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: 75.0%

phosphorochloridic acid diisobutyl ester (17158-87-1) → diisobutyl phosphoric acid (6303-30-6)

Guidance literature:

With sodium hydroxide; In tetrahydrofuran; water; at 0 ℃;

DOI:10.1016/j.jfluchem.2011.08.014

Reference yield: 72.0%

phosphoric acid 2-hydroxy-phenyl ester diisobutyl ester → diisobutyl phosphoric acid (6303-30-6)

Guidance literature:

With [bis(acetoxy)iodo]benzene; water; In acetonitrile; at 20 ℃; for 1h;

DOI:10.1002/jccs.199900133

Reference yield: 36.0%

2-methyl-propan-1-ol (78-83-1) → diisobutyl phosphoric acid (6303-30-6) + phosphonic acid monoisobutyl ester (44744-68-5)

Guidance literature:

With oxygen; hypophosphorous acid; copper dichloride; at 50 ℃; for 6h;

upstream raw materials:

phosphorochloridic acid diisobutyl ester

2-methyl-propan-1-ol

phosphonic acid diisobutyl ester

tris(2-methyl-1-propyl) phosphate radical

Downstream raw materials:

C₁₅H₂₆NO₃P*ClH

diisobutyl (isothiocyanatophenylmethyl)phosphonate

Cyclohexyl-tert-butyl-ammonium-diisobutylphosphat

Refernces

• 1、 Quintana, Jose Benito,Rodil, Rosario,Reemtsma, Thorsten. "Determination of phosphoric acid mono- and diesters in municipal wastewater by solid-phase extraction and ion-pair liquid chromatography-tandem mass spectrometry". . p. 1644 - 1650. Retrieved 2008/02/05.
• 2、 Wu, Pei-Lin,Chen, Jhy-Hong,Huang, Ded-Shih. "Oxidative cleavage of o-hydroxyphenyl phosphate by iodobenzene diacetate". . p. 967 - 970. Retrieved 2007/10/03.