(Dimethylamino)acetone - ≥98% , CAS No.15364-56-4

CAS: 15364-56-4 Cat. No.: D167514 Fórmula: C₅H₁₁NO Peso molecular: 101.15 Beilstein Registry Number: 1740820 Número EC: 239-402-8

GRADE & PURITY ≥98%

Synonyms

(CH3)2NCH2COCH3 | (Dimethylamino)acetone, purum, >=98.0% (GC) | SY106584 | MFCD00008766 | C11H6N2O | (Dimethylamino)acetone | (dimethylamino)-acetone | NSC 96617 | 1,2-Cyclohexanediamine, (1R,2S)-rel- | 1-Dimethylaminoacetone | DIMETHYLAMINOACETONE | FT-0

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Descripción general

(Dimethylamino)acetone interacts with phenol derivatives in carbon tetrachloride and this interaction has been investigated by FT-IR spectroscopy.

Specifications

Sinónimos

(CH3)2NCH2COCH3 | (Dimethylamino)acetone, purum, >=98.0% (GC) | SY106584 | MFCD00008766 | C11H6N2O | (Dimethylamino)acetone | (dimethylamino)-acetone | NSC 96617 | 1,2-Cyclohexanediamine, (1R,2S)-rel- | 1-Dimethylaminoacetone | DIMETHYLAMINOACETONE | FT-0

Especificaciones y pureza

≥98%

Mecanismos bioquímicos y fisiológicos

In carbon tetrachloride, (dimethylamino) acetone interacted with phenol derivatives, and the interaction was studied by FT-IR spectroscopy.

Condiciones de almacenamiento de almacenamiento

Protected from light,Store at -20°C,Argon charged

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504755781
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755781
• Sonrisas canónicas: CC(=O)CN(C)C
• IUPAC Name: 1-(dimethylamino)propan-2-one
• InChIKey: VFPKIWATTACVJR-UHFFFAOYSA-N
• INCHI: 1S/C5H11NO/c1-5(7)4-6(2)3/h4H2,1-3H3
• Isómeros SMILES: CC(=O)CN(C)C
• WGK Alemania: 3
• Peso molecular: 101.15
• Beilstein: 1740820
• Reaxy-Rn: 1740823
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1740823&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Alpha-amino ketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones
• Direct Parent: Alpha-amino ketones
• Alternative Parents: Trialkylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-aminoketone - Tertiary aliphatic amine - Tertiary amine - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha-amino ketones. These are ketones containing a carboxylic acid, and an amine group attached to the alpha carbon atom relative to C=O group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Sensibilidad: light sensitive；air sensitive；heat sensitive
• Índice de refracción: n20/D 1.414 (lit.)
• Punto de inflamación (°F): 86 °F
• Punto de inflamación (°C): 30 °C
• Punto de ebullición (°C): 119-120 °C (lit.)
• Peso molecular: 101.150 g/mol
• XLogP3: 0.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 101.084 Da
• Monoisotopic Mass: 101.084 Da
• Topological Polar Surface Area: 20.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 68.500
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Yanxuan Xiao, Caiyong Song, Hongping Ye, Dan Li, Jiayi Shi, Xiaoke Huang, Qianming Chen, Rui Liu.  (2024)  A ferroptosis-targeting detachable dissolvable microneedle as a combined therapeutic strategy for radiation-induced oral mucositis.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2024.158959]

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 15364-56-4, the molecular formula is C5H11NO, and the molecular weight is 101.15 g/mol. InChIKey VFPKIWATTACVJR-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.