[4-(Hydroxymethyl)oxan-4-yl]methanol

Base Information

• Chemical Name: [4-(Hydroxymethyl)oxan-4-yl]methanol
• CAS No.: 89975-77-9
• Molecular Formula: C7H14O3
• Molecular Weight: 146.186
• Hs Code.: 2932999099
• European Community (EC) Number: 818-298-3
• DSSTox Substance ID: DTXSID60600661
• Wikidata: Q82496849
• Mol file: 89975-77-9.mol

Synonyms:[4-(Hydroxymethyl)oxan-4-yl]methanol;89975-77-9;Tetrahydropyran-4,4-dimethanol;(tetrahydro-2H-pyran-4,4-diyl)dimethanol;(Oxane-4,4-diyl)dimethanol;SCHEMBL3301796;DTXSID60600661;Tetrahydro-4h-pyran-4,4-dimethanol;AKOS006336515;AT29010;BS-24808;DB-189477;EN300-85226;A903894;Z1201628822

Chemical Property of [4-(Hydroxymethyl)oxan-4-yl]methanol

Chemical Property:

• PSA: 49.69000
• LogP: -0.23220
• XLogP3: -0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 146.094294304
• Heavy Atom Count: 10
• Complexity: 91

Purity/Quality:

98% ^*data from raw suppliers

Tetrahydropyran-4,4-dimethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCC1(CO)CO

Technology Process of [4-(Hydroxymethyl)oxan-4-yl]methanol

There total 3 articles about [4-(Hydroxymethyl)oxan-4-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:

4,4-dimethyl dihydro-2H-pyran-4,4(3H)-dicarboxylate (149777-00-4) → (tetrahydro-2H-pyran-4,4-diyl)dimethanol (89975-77-9)

Guidance literature:

4,4-dimethyl dihydro-2H-pyran-4,4(3H)-dicarboxylate; With sodium bis(2-methoxyethoxy)aluminium dihydride; In toluene; at 0 - 120 ℃; for 3h;

With water; In toluene; at 20 ℃;

Reference yield:

tetrahydro-pyran-4,4-dicarboxylic acid diethyl ester (5382-77-4) → (tetrahydro-2H-pyran-4,4-diyl)dimethanol (89975-77-9)

Guidance literature:

With sodium hydroxide; In diethyl ether; water; ethyl acetate;

Reference yield:

→ (tetrahydro-2H-pyran-4,4-diyl)dimethanol (89975-77-9)

Guidance literature:

Red. von Tetrahydropyran-dicarbonsaeure-(4,4)-diaethylester mit LiAlH4, ad. THF dann 2 Stdn. Weiterkochen;

upstream raw materials:

tetrahydro-pyran-4,4-dicarboxylic acid diethyl ester

4,4-dimethyl dihydro-2H-pyran-4,4(3H)-dicarboxylate

Refernces

• 1、 -. "NOVEL PHOSPHODI ESTERASE INHIBITORS". Page/Page column 47-48. . Retrieved 2008/12/08.
• 2、 -. "Cationic complexes of technetium-99m". . . Retrieved 2008/06/13.