Pyrrolidine-2,5-diyldimethanol

Base Information

• Chemical Name: Pyrrolidine-2,5-diyldimethanol
• CAS No.: 5626-66-4
• Molecular Formula: C₆H₁₃NO₂
• Molecular Weight: 131.175
• Hs Code.: 2933990090
• European Community (EC) Number: 810-747-1
• DSSTox Substance ID: DTXSID40559284
• Mol file: 5626-66-4.mol

Synonyms:PYRROLIDINE-2,5-DIYLDIMETHANOL;5626-66-4;[5-(HYDROXYMETHYL)PYRROLIDIN-2-YL]METHANOL;MFCD11973976;2,5-bis(hydroxymethyl)pyrrolidine;2,5-Pyrrolidinedimethanol;SCHEMBL2237799;AMY5557;DTXSID40559284;(Pyrrolidine-2,5-diyl)dimethanol;CS1569;AKOS006354378;AC-31810;AS-46532;SY076230;CS-0453628;EN300-270205;A869986

Chemical Property of Pyrrolidine-2,5-diyldimethanol

Chemical Property:

• Boiling Point: 260.1±15.0 °C(Predicted)
• PKA: 14.47±0.10(Predicted)
• PSA: 52.49000
• Density: 1.076±0.06 g/cm3(Predicted)
• LogP: -0.57960
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: -1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 131.094628657
• Heavy Atom Count: 9
• Complexity: 77.1

Purity/Quality:

97% ^*data from raw suppliers

pyrrolidine-2,5-diyldimethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(NC1CO)CO

Technology Process of Pyrrolidine-2,5-diyldimethanol

There total 3 articles about Pyrrolidine-2,5-diyldimethanol 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: 96.4%

1-benzyl-1H-pyrrole-2,5-bis(carbaldehyde) (160680-85-3) → 2,5-dihydroxymethylpyrrolidine (5626-66-4)

Guidance literature:

With hydrogen; sodium carbonate; In ethanol; water; at 110 ℃; for 5h; under 2250.23 Torr; Reagent/catalyst; Temperature; Pressure; Solvent; Autoclave;

Reference yield: 94.8%

pyrrole-2,5-biscarboxaldehyde (39604-60-9) → 2,5-dihydroxymethylpyrrolidine (5626-66-4)

Guidance literature:

With hydrogen; sodium carbonate; In ethanol; water; at 110 ℃; for 5h; under 2250.23 Torr; Autoclave;

Reference yield:

diethyl meso-2,5-pyrrolidinedicarboxylate (41994-50-7) → 2,5-dihydroxymethylpyrrolidine (5626-66-4)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; at 0 - 20 ℃;

DOI:10.1016/j.cclet.2010.11.030

upstream raw materials:

diethyl meso-2,5-pyrrolidinedicarboxylate

1-benzyl-1H-pyrrole-2,5-bis(carbaldehyde)

pyrrole-2,5-biscarboxaldehyde

Downstream raw materials:

Rifamycin-B-(2,5-bis-hydroxymethyl-pyrrolidid)

3-benzyl-3,8-diazabicyclo[3.2.1]octane