Diacetonamine

Base Information

• Chemical Name: Diacetonamine
• CAS No.: 625-04-7
• Molecular Formula: C6H13NO
• Molecular Weight: 115.175
• Hs Code.: 2922399090
• European Community (EC) Number: 210-876-8
• UNII: WI13YZU3HT
• DSSTox Substance ID: DTXSID3060798
• Nikkaji Number: J6.857H
• Wikidata: Q27292650
• Metabolomics Workbench ID: 171951
• Mol file: 625-04-7.mol

Synonyms:diacetonamine

Chemical Property of Diacetonamine

Chemical Property:

• Melting Point: 125-130 °C (dec.)(lit.)
• Refractive Index: 1.4230 (estimate)
• Boiling Point: 169.4 °C at 760 mmHg
• PKA: 8.84±0.25(Predicted)
• Flash Point: 56.2 °C
• PSA: 43.09000
• Density: 0.896 g/cm³
• LogP: 1.40310
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 115.099714038
• Heavy Atom Count: 8
• Complexity: 96.7

Purity/Quality:

97% ^*data from raw suppliers

Diacetonamine hydrogenoxalate 90% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=O)CC(C)(C)N

Technology Process of Diacetonamine

There total 13 articles about Diacetonamine 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: 75.0%

azido-4 methyl-4 pentanone-2 (41608-07-5) → 4-amino-4-methylpentan-2-one (625-04-7)

Guidance literature:

With dibutyltin; at 15 ℃; for 8h;

DOI:10.1016/S0040-4039(01)81096-0

Reference yield: 27.4%

4-methyl-pent-3-en-2-one (141-79-7) → 4-amino-4-methylpentan-2-one (625-04-7)

Guidance literature:

With ammonium hydroxide; at 45 - 50 ℃; for 4h;

DOI:10.1021/jo00315a020

Reference yield:

acetone (67-64-1) → 2,2,6,6-Tetramethyl-4-piperidone (826-36-8) + 4-hydroxyimino-2,2,6,6-tetramethylpiperidine (4168-79-0) + 4-Hydroxy-4-methyl-2-pentanone (123-42-2) + 2,3-dimethyl-2,3-dinitrobutane (3964-18-9) + 4-amino-4-methylpentan-2-one (625-04-7) + acetone oxime (127-06-0)

Guidance literature:

With ammonia; dihydrogen peroxide; In water; at 69.84 - 74.84 ℃; under 750.075 - 1875.19 Torr; Solvent; Mechanism;

DOI:10.1016/j.molcata.2014.01.003

upstream raw materials:

4-methyl-pent-3-en-2-one

acetone

4-isothiocyanato-4-methylpentan-2-one

azido-4 methyl-4 pentanone-2

Downstream raw materials:

2-acetylamino-2-methyl-4-pentanone

4-methyl-4-salicylidenamino-pentan-2-one

2,2,6,6-Tetramethyl-4-piperidone

4-amino-4-methylpentan-2-ol

Refernces

N-GLYCOSIDES. V. 3-GLYCOSYL-4-HYDROXYHEXAHYDROPYRIMIDINE-2-THIONES AND THEIR ACYCLIC GLYCOSYLTHIOUREA PRECURSORS AS STIMULATORS OF NON-SPECIFIC RESISTANCE TO INFECTION

10.1007/BF01148382

The research focused on investigating the immuno-stimulating properties of certain glycosylthiourea and 3-glycosyl-4-hydroxyhexahydropyrimidine-2-thiones as stimulators of non-specific resistance to infection. The purpose was to understand the action of these compounds on natural immunity, particularly on the resistance of an organism to infection. The study utilized a series of compounds, including 3[B-D-gluco(galacto)-pyranosyl]-4-hydroxyhexahydropyrimidine-2-thiones (I and II), N'-[B-D-gluco(galacto)pyranosyl]-N3-(2-methyl-4-oxopentyl-2)thiourea (III and IV), and N'-[B-D-gluco(galacto)-pyranosyl]-NS-(3,3-diethoxypropyl)thiourea (V and VI), along with their aglycones. The synthesis involved chemicals such as 2,3,5-tri-O-acetyl-8-D-ribofuranosylisothiocyanate (VIII), 4-amino-4-methyl-2-pentanone (IX), and 3,3-diethoxypropylamine (X). The conclusions drawn from the biological experiments indicated that all test compounds demonstrated some level of stimulating action, with an index of resistance ranging from 2 to 6, and were comparable to known immunostimulators like taftsin, rigin, and levamisole. The effectiveness of these compounds was associated with an increase in proliferating processes in lymphoid and hematopoietic tissues, as evidenced by an increase in the number of stem cells in the spleens of lethally irradiated mice that received the test compounds.

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