Piperidine-d11

Base Information

• Chemical Name: Piperidine-d11
• CAS No.: 143317-90-2
• Molecular Formula: C₅H₁₁N
• Molecular Weight: 96.0617
• European Community (EC) Number: 687-096-3
• DSSTox Substance ID: DTXSID60583728
• Nikkaji Number: J1.415.174E
• Wikidata: Q82475331
• Mol file: 143317-90-2.mol

Synonyms:Piperidine-d11;143317-90-2;1,2,2,3,3,4,4,5,5,6,6-undecadeuteriopiperidine;(~2~H_11_)Piperidine;piperidine- d11;Piperidine-d11(9ci);DTXSID60583728;Piperidine-d11, 98 atom % D;AKOS015910803;J-007799

Chemical Property of Piperidine-d11

Chemical Property:

• Vapor Pressure: 28.3mmHg at 25°C
• Melting Point: -13 °C
• Refractive Index: n20/D 1.448(lit.)
• Boiling Point: 106.4 °C at 760 mmHg
• Flash Point: 4.4 °C
• PSA: 12.03000
• Density: 0.938 g/cm³
• LogP: 1.08870
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 96.158193561
• Heavy Atom Count: 6
• Complexity: 30.9

Purity/Quality:

98%min ^*data from raw suppliers

Piperidine-d11 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,T
• Hazard Codes: F,T
• Statements: 11-23/24-34
• Safety Statements: 16-26-27-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCNCC1
• Isomeric SMILES: [2H]C1(C(C(N(C(C1([2H])[2H])([2H])[2H])[2H])([2H])[2H])([2H])[2H])[2H]
• Uses: Labeled PIPERIDINE-D11, intended for use as an internal standard for the quantification of piperidine by GC- or LC-mass spectrometry.

Technology Process of Piperidine-d11

There total 1 articles about Piperidine-d11 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:

1,5-diaminopentane (462-94-2) → piperidine-d11 (143317-90-2)

Guidance literature:

With 5 wt% ruthenium/carbon; water-d2; aluminium; at 158 ℃;

DOI:10.1016/j.tet.2009.12.025

Reference yield:

piperidine-d11 (143317-90-2) → 3-oxo-3-phenyl-2-((2H10) piperidin-1-yl)propanenitrile

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / acetonitrile / 70 °C

2: sodium hexamethyldisilazane / tetrahydrofuran / 0 - 20 °C

With sodium hexamethyldisilazane; potassium carbonate; In tetrahydrofuran; acetonitrile;

Reference yield:

piperidine-d11 (143317-90-2) → 3-phenyl-4-((2H10)piperidin-1-yl)-1H-pyrazol-5-amine

Guidance literature:

Multi-step reaction with 3 steps

1: potassium carbonate / acetonitrile / 70 °C

2: sodium hexamethyldisilazane / tetrahydrofuran / 0 - 20 °C

3: acetic acid; hydrazine hydrate / ethanol / 5 h / Reflux

With sodium hexamethyldisilazane; potassium carbonate; hydrazine hydrate; acetic acid; In tetrahydrofuran; ethanol; acetonitrile;

upstream raw materials:

1,5-diaminopentane

Refernces