tert-Butyl 6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate

Base Information

• Chemical Name: tert-Butyl 6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate
• CAS No.: 73839-25-5
• Molecular Formula: C₁₂H₂₄BrO₆P
• Molecular Weight: 375.197
• Mol file: 73839-25-5.mol

Synonyms:6-[[(2-Bromoethoxy)hydroxyphosphinyl]oxy]-hexanoic Acid 1,1-Dimethylethyl Este;tert-Butyl 6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate;6-[[(2-Bromoethoxy)hydroxyphosphinyl]oxy]-hexanoic Acid 1,1-Dimethylethyl Ester

Chemical Property of tert-Butyl 6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.481
• Boiling Point: 413.773°C at 760 mmHg
• PKA: 1.39±0.50(Predicted)
• Flash Point: 204.043°C
• Density: 1.351g/cm³
• Storage Temp.: Hygroscopic, -20°C Freezer, Under Inert Atmosphere
• Solubility.: Chloroform

Purity/Quality:

95% ^*data from raw suppliers

tert-Butyl6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: tert-Butyl 6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate (cas# 73839-25-5) is a compound useful in organic synthesis.

Technology Process of tert-Butyl 6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate

There total 3 articles about tert-Butyl 6-[O-(2-Bromoethyl)phosphoryl)hydroxyhexanoate 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:

6-bromohexanoic acid (4224-70-8) → tert-butyl 6-(O-(2-bromoethyl)phosphoryl)hydroxyhexanoate (73839-25-5)

Guidance literature:

Multi-step reaction with 3 steps

1: 93 percent / H₂SO₄ / CH₂Cl₂ / Ambient temperature

2: 1) sodium formate, 2) KOH / 1) DMF, a) 110 deg C, 4h, b) RT, 2 days, 2) H₂O, 30-40 deg C, 4h

3: 1) triethylamine, 2) pyridine, H₂O / 1) RT, 1h, 2) RT

With pyridine; potassium hydroxide; sulfuric acid; water; sodium formate; triethylamine; In dichloromethane;

DOI:10.1021/jo01303a029

Reference yield:

tert-butyl 6-bromohexanoate (65868-63-5) → tert-butyl 6-(O-(2-bromoethyl)phosphoryl)hydroxyhexanoate (73839-25-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 1) sodium formate, 2) KOH / 1) DMF, a) 110 deg C, 4h, b) RT, 2 days, 2) H₂O, 30-40 deg C, 4h

2: 1) triethylamine, 2) pyridine, H₂O / 1) RT, 1h, 2) RT

With pyridine; potassium hydroxide; water; sodium formate; triethylamine;

DOI:10.1021/jo01303a029

Reference yield:

2-bromoethylphosphoric acid dichloride (4167-02-6) + tert-butyl 6-hydroxyhexanoate (73839-20-0) → tert-butyl 6-(O-(2-bromoethyl)phosphoryl)hydroxyhexanoate (73839-25-5)

Guidance literature:

With pyridine; water; triethylamine; Yield given. Multistep reaction; 1) RT, 1h, 2) RT;

DOI:10.1021/jo01303a029

upstream raw materials:

2-bromoethylphosphoric acid dichloride

tert-butyl 6-hydroxyhexanoate

6-bromohexanoic acid

tert-butyl 6-bromohexanoate

Downstream raw materials:

6-(O-phosphorylcholine)hydroxyhexanoic acid

tert-butyl 6-(O-phosphorylcholine)hydroxyhexanoate

p-nitrophenyl 6-(O-phosphorylcholine)hydroxyhexanoate