Trineopentyl orthoborate

Base Information

• Chemical Name: Trineopentyl orthoborate
• CAS No.: 5456-06-4
• Molecular Formula: C15H33BO3
• Molecular Weight: 272.236
• Hs Code.: 2920909090
• European Community (EC) Number: 226-712-3
• NSC Number: 7433
• UNII: B87DY32KJ9
• DSSTox Substance ID: DTXSID00202981
• Nikkaji Number: J210.510A
• Wikidata: Q83076344
• Mol file: 5456-06-4.mol

Synonyms:Trineopentyl orthoborate;5456-06-4;NSC-7433;NSC7433;Boric acid trineopentyl ester;B87DY32KJ9;Neopentyl borate (C5H11O)3B;DTXSID00202981;NSC 7433;EINECS 226-712-3;1-Propanol, 2,2-dimethyl-, triester with boric acid (H3BO3)

Chemical Property of Trineopentyl orthoborate

Chemical Property:

• Vapor Pressure: 0.00976mmHg at 25°C
• Boiling Point: 273.1°C at 760 mmHg
• Flash Point: 80.8°C
• PSA: 27.69000
• Density: 0.857g/cm³
• LogP: 4.15940
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 272.2522751
• Heavy Atom Count: 19
• Complexity: 203

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(OCC(C)(C)C)(OCC(C)(C)C)OCC(C)(C)C

Technology Process of Trineopentyl orthoborate

There total 1 articles about Trineopentyl orthoborate 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:

2,2-dimethyl-propanol-1 (75-84-3) → tris(neopentyloxy)borane (5456-06-4)

Guidance literature:

With boron trichloride; pentane; at -80 ℃;

DOI:10.1039/jr9550003084

Reference yield:

tris(neopentyloxy)borane (5456-06-4) + water (7732-18-5) → 2,2-dimethyl-propanol-1 (75-84-3) + boric acid (11113-50-1,14635-83-7)

Guidance literature:

In water; hydrolysis;;

DOI:10.1021/ja01228a024

upstream raw materials:

2,2-dimethyl-propanol-1

Downstream raw materials:

2,2-dimethyl-propanol-1

boric acid