2,3,5-Triiodobenzyl alcohol

Base Information

• Chemical Name: 2,3,5-Triiodobenzyl alcohol
• CAS No.: 31075-53-3
• Molecular Formula: C₇H₅I₃O
• Molecular Weight: 485.83
• Hs Code.: 2906299090
• European Community (EC) Number: 625-813-3
• DSSTox Substance ID: DTXSID60393026
• Nikkaji Number: J3.459.041I
• Wikidata: Q82191626
• Mol file: 31075-53-3.mol

Synonyms:2,3,5-Triiodobenzyl alcohol;31075-53-3;(2,3,5-triiodophenyl)methanol;2,3,5-Triiodobenzenemethanol;SCHEMBL2370163;DTXSID60393026;2,3,5-Triiodobenzyl alcohol, 97%;AKOS015888994;J-018235

Chemical Property of 2,3,5-Triiodobenzyl alcohol

Chemical Property:

• Vapor Pressure: 1.38E-08mmHg at 25°C
• Melting Point: 156-159 °C(lit.)
• Boiling Point: 441.9°C at 760 mmHg
• Flash Point: 221.1°C
• PSA: 20.23000
• Density: 2.866g/cm³
• LogP: 2.99270
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 485.7475
• Heavy Atom Count: 11
• Complexity: 131

Purity/Quality:

99% ^*data from raw suppliers

2,3,5-Triiodobenzyl alcohol 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1CO)I)I)I

Technology Process of 2,3,5-Triiodobenzyl alcohol

There total 1 articles about 2,3,5-Triiodobenzyl alcohol 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:

2,3,5-triiodobenzoic acid (88-82-4) → 2,3,5-triiodobenzyl alcohol (31075-53-3)

Guidance literature:

With borane-THF; In tetrahydrofuran; at 25 ℃; for 20h; Inert atmosphere;

Reference yield:

2,3,5-triiodobenzyl alcohol (31075-53-3) → 2,3,5-triiodobenzaldehyde (477534-99-9)

Guidance literature:

With 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane-2,4,6-trioxide; In dimethyl sulfoxide; ethyl acetate; at 22 - 25 ℃; for 0.0833333h; Inert atmosphere;

Reference yield:

1-bromo-2,2-dimethoxyethane (7252-83-7) + 2,3,5-triiodobenzyl alcohol (31075-53-3) → 1-(2,2-dimethoxyethoxymethyl)-2,3,5-triiodobenzene

Guidance literature:

With sodium hydride; In 2-methyltetrahydrofuran; mineral oil; Reflux;

upstream raw materials:

2,3,5-triiodobenzoic acid

Downstream raw materials:

2,3,5-triiodobenzaldehyde

Refernces