2,2-Dimethylpiperidine

Base Information

• Chemical Name: 2,2-Dimethylpiperidine
• CAS No.: 54152-47-5
• Molecular Formula: C7H15 N
• Molecular Weight: 113.203
• Hs Code.: 2933399090
• European Community (EC) Number: 259-002-7
• DSSTox Substance ID: DTXSID30202499
• Nikkaji Number: J279.592B
• Wikidata: Q83075783
• Mol file: 54152-47-5.mol

Synonyms:2,2-Dimethylpiperidine;54152-47-5;2,2-DIMETHYL-PIPERIDINE;EINECS 259-002-7;MFCD10696890;Piperidine, 2,2-dimethyl-;6-dimethylpiperidine;SCHEMBL989854;DTXSID30202499;AKOS005145511;AB58454;AT24207;BB 0261170;EN300-219921

Chemical Property of 2,2-Dimethylpiperidine

Chemical Property:

• Vapor Pressure: 7.6mmHg at 25°C
• Boiling Point: 135.8°Cat760mmHg
• PKA: 10.82±0.10(Predicted)
• Flash Point: 24.9°C
• PSA: 12.03000
• Density: 0.803g/cm³
• LogP: 1.86730
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 113.120449483
• Heavy Atom Count: 8
• Complexity: 76.5

Purity/Quality:

97% ^*data from raw suppliers

2,2-dimethylpiperidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CCCCN1)C

Technology Process of 2,2-Dimethylpiperidine

There total 2 articles about 2,2-Dimethylpiperidine 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: 45.0%

→ 2,2-dimethylpiperidine (54152-47-5) + 3-(2,2-dimethylpiperidin-1-yl)-sydnone imine hydrochloride

Guidance literature:

Reference yield:

6,6-dimethyl-2-piperidinone (139524-56-4) → 2,2-dimethylpiperidine (54152-47-5)

Guidance literature:

With sodium hydroxide; In diethyl ether; water;

Reference yield: 100.0%

2,2-dimethylpiperidine (54152-47-5) + 4-((S)-3-(((S)-4-(4-acetoxypiperidin-1-yl)-1-((3,4-dichloro-2-fluorophenyl)amino)-1-oxobutan-2-yl)carbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl)-4-oxobutanoic acid → 1-((S)-4-((3,4-dichloro-2-fluorophenyl)amino)-3-((S)-2-(4-(2,2-dimethylpiperidin-1-yl)-4-oxobutanoyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamido)-4-oxobutyl)piperidin-4-yl acetate

Guidance literature:

With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In dichloromethane; at 0 - 20 ℃; for 1.66667h;

upstream raw materials:

6,6-dimethyl-2-piperidinone

Downstream raw materials:

2-(1-hydroxy-6,6-dimethylpiperidin-2-yl)cyclohexane-1,3-dione