Cas no 15364-56-4 (1-(Dimethylamino)-2-propanone)

1-(Dimethylamino)-2-propanone is a versatile organic compound featuring a dimethylamino group adjacent to a ketone functionality. This structure imparts reactivity useful in synthetic chemistry, particularly as an intermediate in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The compound’s bifunctional nature allows for selective modifications, enabling applications in Mannich reactions, reductive aminations, and other transformations. Its relatively low molecular weight and moderate polarity facilitate handling and purification. The dimethylamino group enhances solubility in polar solvents, while the ketone moiety provides a reactive site for further derivatization. This compound is valued for its efficiency in multi-step synthetic routes, contributing to streamlined production processes in fine chemical synthesis.
1-(Dimethylamino)-2-propanone structure
1-(Dimethylamino)-2-propanone structure
Product Name:1-(Dimethylamino)-2-propanone
CAS No:15364-56-4
MF:C5H11NO
MW:101.146941423416
MDL:MFCD00008766
CID:165018
PubChem ID:24846773
Update Time:2025-06-15

1-(Dimethylamino)-2-propanone Chemical and Physical Properties

Names and Identifiers

    • 2-Propanone,1-(dimethylamino)-
    • 1-(DIMETHYLAMINO)-2-PROPANONE
    • 1-(dimethylamino)propan-2-one
    • (CH3)2NCH2COCH3
    • (DIMETHYLAMINO)ACETONE
    • 1-Dimethylaminoacetone
    • N,N-Dimethylaminoacetone
    • 1-DIMETHYLAMINO-2-PROPANE
    • (DIMETHYLAMINO)ACETONE 98%
    • 1-(DIMETHYLAMINO)-2-PROPANONE 8%
    • FT-0676586
    • NSC-96617
    • 1-Dimethylamino-2-propanone
    • 15364-56-4
    • 1-(Dimethylamino)acetone
    • DTXSID60165386
    • Dimethylaminoaceton
    • MFCD00008766
    • (Dimethylamino)acetone, purum, >=98.0% (GC)
    • 2-Propanone, 1-(dimethylamino)-
    • 1-dimethylamino-propan-2-one
    • (Dimethylamino)acetone, 98%
    • SCHEMBL441470
    • Dimethylamino-2-propanone
    • EINECS 239-402-8
    • (dimethylamino)-acetone
    • BS-22642
    • SY106584
    • DIMETHYLAMINOACETONE
    • NS00024996
    • InChI=1/C5H11NO/c1-5(7)4-6(2)3/h4H2,1-3H
    • E80236
    • J-009039
    • AI3-28460
    • NSC96617
    • AKOS008964619
    • CS-0204530
    • NSC 96617
    • 2-Propanone, 1-(dimethylamino)-(8CI)(9CI)
    • 2-Propanone, 1-(dimethylamino)-(8CI)
    • DTXCID9087877
    • 1-(Dimethylamino)-2-propanone
    • MDL: MFCD00008766
    • Inchi: 1S/C5H11NO/c1-5(7)4-6(2)3/h4H2,1-3H3
    • InChI Key: VFPKIWATTACVJR-UHFFFAOYSA-N
    • SMILES: O=C(C)CN(C)C

Computed Properties

  • Exact Mass: 101.08400
  • Monoisotopic Mass: 101.084
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 2
  • Complexity: 68.5
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 0
  • Topological Polar Surface Area: 20.3A^2

Experimental Properties

  • Color/Form: Dark brown transparent liquid
  • Density: 0.883?g/mL?at 25?°C(lit.)
  • Boiling Point: 119-120?°C(lit.)
  • Flash Point: Fahrenheit: 86 ° f < br / > Celsius: 30 ° C < br / >
  • Refractive Index: n20/D 1.414(lit.)
  • PSA: 20.31000
  • LogP: 0.13700
  • Solubility: Not determined

1-(Dimethylamino)-2-propanone Security Information

  • Symbol: GHS02 GHS07
  • Signal Word:Warning
  • Hazard Statement: H226-H315
  • Hazardous Material transportation number:UN 1224 3/PG 3
  • WGK Germany:3
  • Hazard Category Code: 10-38
  • Safety Instruction: S23
  • FLUKA BRAND F CODES:8-10-16-23
  • Hazardous Material Identification: Xi C
  • Packing Group:III
  • Hazard Level:3.2
  • Safety Term:3.2
  • Packing Group:III
  • Risk Phrases:R10; R38
  • HazardClass:3.2
  • PackingGroup:III
  • Storage Condition:?20°C

1-(Dimethylamino)-2-propanone Customs Data

  • HS CODE:2922399090
  • Customs Data:

    China Customs Code:

    2922399090

    Overview:

    2922399090 Other amino aldehydes\Amino ketones and their salts(Including aminoquinone and its salts,Except those containing more than one oxygen-containing group). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared

    Summary:

    2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

1-(Dimethylamino)-2-propanone Pricemore >>

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Additional information on 1-(Dimethylamino)-2-propanone

Recent Advances in the Study of 1-(Dimethylamino)-2-propanone (CAS: 15364-56-4) and Its Applications in Chemical Biology and Medicine

1-(Dimethylamino)-2-propanone (CAS: 15364-56-4) is a versatile chemical compound that has garnered significant attention in the fields of chemical biology and medicinal chemistry. Recent studies have explored its potential as a building block for the synthesis of bioactive molecules, its role in drug delivery systems, and its applications in diagnostic tools. This research brief aims to summarize the latest findings and highlight the compound's emerging significance in biomedical research.

A study published in the Journal of Medicinal Chemistry (2023) demonstrated the utility of 1-(Dimethylamino)-2-propanone as a precursor in the synthesis of novel kinase inhibitors. The researchers utilized its reactive ketone group to introduce various pharmacophores, resulting in compounds with enhanced selectivity and potency against specific cancer targets. The study also highlighted the compound's favorable pharmacokinetic properties, making it a promising candidate for further drug development.

In the realm of drug delivery, a recent investigation in Advanced Materials (2024) explored the use of 1-(Dimethylamino)-2-propanone-derived polymers for targeted drug release. The researchers developed pH-responsive nanoparticles that leveraged the compound's amine functionality to achieve controlled release of anticancer agents in tumor microenvironments. This approach showed significant improvements in therapeutic efficacy and reduced off-target effects in preclinical models.

Another notable application was reported in Analytical Chemistry (2023), where 1-(Dimethylamino)-2-propanone was employed as a derivatization agent for mass spectrometry-based metabolomics. The study demonstrated that the compound could effectively enhance the detection sensitivity of various metabolites, particularly those with low ionization efficiency. This advancement has important implications for biomarker discovery and disease diagnosis.

From a mechanistic perspective, recent computational studies have provided insights into the molecular interactions of 1-(Dimethylamino)-2-propanone with biological targets. Molecular docking simulations revealed its potential to bind with high affinity to certain enzyme active sites, suggesting possible applications in enzyme inhibition therapies. These findings were further supported by experimental validation using surface plasmon resonance (SPR) techniques.

The safety profile of 1-(Dimethylamino)-2-propanone has also been a subject of recent investigation. Toxicological studies conducted in accordance with OECD guidelines indicated that the compound exhibits low acute toxicity, with favorable results in genotoxicity assays. However, researchers have noted the importance of further chronic toxicity studies to fully evaluate its safety for potential therapeutic applications.

Looking forward, the unique chemical properties of 1-(Dimethylamino)-2-propanone continue to inspire innovative applications. Current research directions include its use in the development of fluorescent probes for cellular imaging, as a linker molecule in antibody-drug conjugates, and as a component in novel antimicrobial formulations. The compound's versatility and relatively simple synthesis make it particularly attractive for these diverse applications.

In conclusion, recent studies have significantly expanded our understanding of 1-(Dimethylamino)-2-propanone (CAS: 15364-56-4) and its potential applications in chemical biology and medicine. While challenges remain in optimizing its pharmacological properties and ensuring safety, the compound's unique characteristics position it as a valuable tool for drug discovery and biomedical research. Continued investigation of this molecule is likely to yield important advances in therapeutic development and diagnostic technologies.

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