1-Propylpiperidine

Base Information

• Chemical Name: 1-Propylpiperidine
• CAS No.: 5470-02-0
• Molecular Formula: C8H17N
• Molecular Weight: 127.23
• Hs Code.: 2933399090
• NSC Number: 27434
• UNII: 7W3CN3E15S
• DSSTox Substance ID: DTXSID80203158
• Nikkaji Number: J50.682F
• Wikidata: Q83076509
• ChEMBL ID: CHEMBL2448946
• Mol file: 5470-02-0.mol

Synonyms:1-PROPYLPIPERIDINE;Piperidine, 1-propyl-;N-Propylpiperidine;Propylpiperidine;5470-02-0;Piperidine, N-propyl-;1-propyl-piperidine;NSC 27434;BRN 0102930;7W3CN3E15S;NSC-27434;5-20-02-00027 (Beilstein Handbook Reference);propylpiperidin;NSC27434;n-n-propylpiperidine;1-n-propylpiperidine;starbld0032222;WLN: T6NTJ A3;UNII-7W3CN3E15S;SCHEMBL81143;CHEMBL2448946;DTXSID80203158;AKOS006221614;LS-116154

Chemical Property of 1-Propylpiperidine

Chemical Property:

• Vapor Pressure: 3.63mmHg at 25°C
• Melting Point: -1°C (estimate)
• Refractive Index: 1.4446
• Boiling Point: 151.6°Cat760mmHg
• PKA: 9.84±0.10(Predicted)
• Flash Point: 39.8°C
• PSA: 3.24000
• Density: 0.839g/cm³
• LogP: 1.82020
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 127.136099547
• Heavy Atom Count: 9
• Complexity: 65

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s): A poison.
• Hazard Codes: A poison.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1CCCCC1

Technology Process of 1-Propylpiperidine

There total 14 articles about 1-Propylpiperidine 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: 96.0%

piperidine (110-89-4) + propyloxy(diphenyl)-λ6-sulfanenitrile (143885-02-3) → N-propylpiperidine (5470-02-0) + S,S-diphenylsulphoximine (22731-83-5)

Guidance literature:

at 40 ℃; for 24h;

DOI:10.1002/hc.20006

Reference yield: 51.0%

Tetrahydrofurfuryl alcohol (97-99-4) + propiononitrile (107-12-0) → N-propylpiperidine (5470-02-0) + N-propyltetrahydrofurfurylamine (7179-87-5)

Guidance literature:

With hydrogen; magnesium oxide; copper; at 230 ℃; under 11400 Torr;

DOI:10.1007/BF00475557

Reference yield: 51.0%

Tetrahydrofurfuryl alcohol (97-99-4) + propiononitrile (107-12-0) → N-propylpiperidine (5470-02-0) + N-propyltetrahydrofurfurylamine (7179-87-5)

Guidance literature:

With hydrogen; magnesium oxide; copper; at 230 ℃; under 11400 Torr; Mechanism; Product distribution; other catalysts; other temperature; other pressure;

DOI:10.1007/BF00475557

upstream raw materials:

piperidine

carbon monoxide

Tetrahydrofurfuryl alcohol

propiononitrile

Downstream raw materials:

3-propylpyridine

propyl bromide

3-(piperidin-1-yl)propyl pivalate

1-(piperidin-1-yl)propan-2-ol