2-Methylnitrosopiperidine

Base Information

• Chemical Name: 2-Methylnitrosopiperidine
• CAS No.: 7247-89-4
• Molecular Formula: C6H12 N2 O
• Molecular Weight: 128.174
• NSC Number: 51624
• DSSTox Substance ID: DTXSID20860128
• Nikkaji Number: J2.257H
• ChEMBL ID: CHEMBL165747
• Mol file: 7247-89-4.mol

Synonyms:2-Methylnitrosopiperidine;2-Methyl-1-nitrosopiperidine;7247-89-4;Piperidine, 2-methyl-N-nitroso-;1-Nitroso-2-pipecoline;1-Nitrosopipecoline;N-Nitroso-2-methylpiperidine;Piperidine, 2-methyl-1-nitroso-;2-PIPECOLINE, 1-NITROSO-;2-METHYL-N-NITROSOPIPERIDINE;NSC 51624;34962-90-8;nitroso-2-methylpiperidine;CHEMBL165747;SCHEMBL2352775;2-Methyl-1-nitrosopiperidine #;DTXSID20860128;NSC51624;NSC-51624;LS-109831;EN300-253080

Chemical Property of 2-Methylnitrosopiperidine

Chemical Property:

• Refractive Index: 1.4880 (estimate)
• Boiling Point: 237.61°C (rough estimate)
• PKA: -3.11±0.40(Predicted)
• PSA: 32.67000
• Density: 1.0754 (rough estimate)
• LogP: 1.48010
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 128.094963011
• Heavy Atom Count: 9
• Complexity: 105

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Safety Statements: Questionable carcinogen with experimental tumorigenic data. Mutation data report"> x. See also NITROSO COMPOUNDS." target="_blank">Questionable carcinogen with experimental tumorigenic data. Mutation data report

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Nitrosamines
• Canonical SMILES: CC1CCCCN1N=O

Technology Process of 2-Methylnitrosopiperidine

There total 2 articles about 2-Methylnitrosopiperidine 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:

n-propyl nitrite (543-67-9) + 2-Methylpiperidin (109-05-7,3000-79-1) → propan-1-ol (71-23-8) + 2-methyl-1-nitroso-piperidine (7247-89-4)

Guidance literature:

With sodium hydroxide; In water; at 25 ℃; Rate constant;

Reference yield:

n-Butyl nitrite (544-16-1) + 2-Methylpiperidin (109-05-7,3000-79-1) → 2-methyl-1-nitroso-piperidine (7247-89-4) + butan-1-ol (71-36-3)

Guidance literature:

With sodium hydroxide; In water; at 25 ℃; Rate constant;

Reference yield:

sulfuric acid (7664-93-9) + 2-methyl-1-nitroso-piperidine (7247-89-4) → ammonia (7664-41-7) + 2-Methylpiperidin (109-05-7,3000-79-1)

Guidance literature:

bei der elektrolytischen Reduktion;

upstream raw materials:

n-propyl nitrite

2-Methylpiperidin

n-Butyl nitrite

Downstream raw materials:

ammonia

nitric acid

methylammonium carbonate

2-Methylpiperidin

Refernces