3-iodocholic acid

Base Information

• Chemical Name: 3-iodocholic acid
• CAS No.: 85121-73-9
• Molecular Formula: C₂₄H₃₉IO₄
• Molecular Weight: 518.476
• Mol file: 85121-73-9.mol

Synonyms:3-Iodocholic acid;

Chemical Property of 3-iodocholic acid

Chemical Property:

• Vapor Pressure: 6.71E-17mmHg at 25°C
• Boiling Point: 600°C at 760 mmHg
• Flash Point: 316.7°C
• PSA: 77.76000
• Density: 1.43g/cm³
• LogP: 4.89140

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-iodocholic acid

There total 3 articles about 3-iodocholic 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: 83.0%

7α-hydroxy-3α-iod-5β-cholansaeure-24,12α-lacton (88165-74-6) → 7α,12α-dihydroxy-3α-iod-5β-cholansaeure (85121-73-9)

Guidance literature:

With potassium hydroxide; In methanol; for 48h;

DOI:10.1016/S0040-4020(01)82452-2

Reference yield:

7α-hydroxy-3α-phenylsulfonyloxy-5β-cholansaeure-24,12α-lacton (88202-27-1) → 7α,12α-dihydroxy-3α-iod-5β-cholansaeure (85121-73-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 37 percent / NaI / acetone / 48 h / Heating

2: 83 percent / KOH / methanol / 48 h

With potassium hydroxide; sodium iodide; In methanol; acetone;

DOI:10.1016/S0040-4020(01)82452-2

Reference yield:

cholsaeure (81-25-4,2464-18-8,2955-27-3,3338-16-7,10322-18-6,15073-87-7,30634-97-0,63324-19-6,63324-20-9,71883-64-2,71883-66-4,81873-90-7,81938-67-2,105227-32-5,105227-33-6,105227-34-7,105227-35-8,106927-36-0,106927-37-1,130009-06-2) → 7α,12α-dihydroxy-3α-iod-5β-cholansaeure (85121-73-9)

Guidance literature:

Multi-step reaction with 3 steps

1: 56 percent / pyridine / 48 h / 5 °C

2: 37 percent / NaI / acetone / 48 h / Heating

3: 83 percent / KOH / methanol / 48 h

With potassium hydroxide; sodium iodide; In pyridine; methanol; acetone;

DOI:10.1016/S0040-4020(01)82452-2

upstream raw materials:

7α-hydroxy-3α-iod-5β-cholansaeure-24,12α-lacton

7α-hydroxy-3α-phenylsulfonyloxy-5β-cholansaeure-24,12α-lacton

cholsaeure

Refernces