1-[2-(Hydroxymethyl)piperidin-1-yl]ethan-1-one

Base Information

• Chemical Name: 1-[2-(Hydroxymethyl)piperidin-1-yl]ethan-1-one
• CAS No.: 19028-69-4
• Molecular Formula: C₈H₁₅NO₂
• Molecular Weight: 157.213
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID10554908
• Nikkaji Number: J1.927.636H
• Mol file: 19028-69-4.mol

Synonyms:19028-69-4;1-(2-Hydroxymethyl-piperidin-1-yl)-ethanone;1-[2-(hydroxymethyl)piperidin-1-yl]ethan-1-one;2-Piperidinemethanol, 1-acetyl- (8CI,9CI);1-[2-(HYDROXYMETHYL)PIPERIDIN-1-YL]ETHANONE;1-(2-(hydroxymethyl)piperidin-1-yl)ethanone;SCHEMBL10311750;DTXSID10554908;(1-Acetyl-2-piperidinyl)methanol;AKOS009143183;SB42187;AM100444;EN300-91544;G47900;Z275745460

Chemical Property of 1-[2-(Hydroxymethyl)piperidin-1-yl]ethan-1-one

Chemical Property:

• Boiling Point: 309.8±15.0 °C(Predicted)
• PKA: 15.08±0.10(Predicted)
• PSA: 40.54000
• Density: 1.067±0.06 g/cm3(Predicted)
• LogP: 0.31760
• XLogP3: 0
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 157.110278721
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

≥95% ^*data from raw suppliers

1-(2-Hydroxymethylpiperidin-1-yl)ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N1CCCCC1CO

Technology Process of 1-[2-(Hydroxymethyl)piperidin-1-yl]ethan-1-one

There total 3 articles about 1-[2-(Hydroxymethyl)piperidin-1-yl]ethan-1-one 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:

2,2,2-trifluoroethyl acetate (406-95-1) + piperidin-2-ylmethanol (3433-37-2) → (1-acetyl-piperidin-2-yl)-methanol (19028-69-4) + N-acetyl-2-acetoxymethylpiperidine (19028-68-3) + 2-piperidinemethanol acetate

Guidance literature:

With chirazyme L₅; immobilised Candida antarctica lipase A; In various solvent(s); at 23 - 24 ℃; for 49h;

DOI:10.1002/adsc.200303018

Reference yield:

Isopropenyl acetate (108-22-5) + piperidin-2-ylmethanol (3433-37-2) → (1-acetyl-piperidin-2-yl)-methanol (19028-69-4)

Guidance literature:

DOI:10.1016/S0040-4039(00)79903-5

Reference yield:

→ (1-acetyl-piperidin-2-yl)-methanol (19028-69-4)

Guidance literature:

2-Acetoxymethyl-1-acetylpiperidin, methanol. NH3;

DOI:10.1016/0040-4020(68)88115-3

upstream raw materials:

Isopropenyl acetate

piperidin-2-ylmethanol

2,2,2-trifluoroethyl acetate

Downstream raw materials:

N-acetyl-2-piperidinecarboxaldehyde