[(2s,6s)-6-(Iodomethyl)-1,4-dioxan-2-yl]methanol

Base Information

• Chemical Name: [(2s,6s)-6-(Iodomethyl)-1,4-dioxan-2-yl]methanol
• CAS No.: 6963-00-4
• Molecular Formula: C₆H₁₁IO₃
• Molecular Weight: 258.056
• NSC Number: 53704
• DSSTox Substance ID: DTXSID90287969
• Nikkaji Number: J739.340G

Synonyms:6963-00-4;[(2s,6s)-6-(iodomethyl)-1,4-dioxan-2-yl]methanol;NSC53704;DTXSID90287969;NSC-53704

Chemical Property of [(2s,6s)-6-(Iodomethyl)-1,4-dioxan-2-yl]methanol

Chemical Property:

• Vapor Pressure: 2.95E-05mmHg at 25°C
• Boiling Point: 318.6°Cat760mmHg
• Flash Point: 146.5°C
• Density: 1.755g/cm³
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 257.97529
• Heavy Atom Count: 10
• Complexity: 99

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(OC(CO1)CI)CO
• Isomeric SMILES: C1[C@@H](O[C@@H](CO1)CI)CO

Technology Process of [(2s,6s)-6-(Iodomethyl)-1,4-dioxan-2-yl]methanol

There total 4 articles about [(2s,6s)-6-(Iodomethyl)-1,4-dioxan-2-yl]methanol 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: 26.0%

glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → 3,7,9-Trioxa-bicyclo<3.3.1>nonan (281-09-4) + ((2R,6S)-6-Iodomethyl-[1,4]dioxan-2-yl)-methanol (6963-00-4) + ((2S,6S)-6-Iodomethyl-[1,4]dioxan-2-yl)-methanol (6963-00-4) + ((2S,5S)-5-Iodomethyl-[1,4]dioxan-2-yl)-methanol

Guidance literature:

With iodine; toluene-4-sulfonic acid; In toluene; at 100 - 120 ℃; Further byproducts given;

DOI:10.1002/(SICI)1097-458X(199606)34:6<434::AID-OMR897>3.0.CO;2-O

Reference yield: 26.0%

glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → 3,7,9-Trioxa-bicyclo<3.3.1>nonan (281-09-4) + ((2R,6S)-6-Iodomethyl-[1,4]dioxan-2-yl)-methanol (6963-00-4) + ((2S,6S)-6-Iodomethyl-[1,4]dioxan-2-yl)-methanol (6963-00-4) + ((2S,5S)-5-Iodomethyl-[1,4]dioxan-2-yl)-methanol

Guidance literature:

With iodine; toluene-4-sulfonic acid; In toluene; at 100 - 120 ℃; Further byproducts given;

DOI:10.1002/(SICI)1097-458X(199606)34:6<434::AID-OMR897>3.0.CO;2-O

Reference yield: 15.0%

glycerol (56-81-5,25618-55-7,64333-26-2,8013-25-0) → ((2R,6S)-6-Iodomethyl-[1,4]dioxan-2-yl)-methanol (6963-00-4) + ((2S,6S)-6-Iodomethyl-[1,4]dioxan-2-yl)-methanol (6963-00-4) + ((2S,5S)-5-Iodomethyl-[1,4]dioxan-2-yl)-methanol + ((2R,5S)-5-Iodomethyl-[1,4]dioxan-2-yl)-methanol

Guidance literature:

With iodine; toluene-4-sulfonic acid; In toluene; at 100 - 120 ℃; Further byproducts given;

DOI:10.1002/(SICI)1097-458X(199606)34:6<434::AID-OMR897>3.0.CO;2-O

upstream raw materials:

glycerol

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