1,1-Dimethoxyacetone - ≥97%(GC) , CAS No.6342-56-9

CAS: 6342-56-9 Cat. No.: P135662 Summenformel: C₅H₁₀O₃ Molekulargewicht: 118.13 Beilstein Registry Number: 1(4)3631 EG-Nummer: 228-735-4 PubChem CID: 80650

GRADE & PURITY ≥97%(GC)

Synonyms

P1264 | NSC 50127 | NSC50127 | NSC-50127 | FT-0606125 | 1,1-bis(methyloxy)-2-propanone | Methylglyoxal 1,1-dimethyl acetal pound>>2-Propanone, 1,1-dimethoxy- | MFCD00008758 | Pyruvaldehyde-1-dimethyl acetal | Methylglyoxal 1,1-dimethyl acetal, >=97% | J-5

Storage

Argon charged,Room temperature

Shipped In

Normal

Übersicht

Methylglyoxal 1,1-dimethyl acetal was used in the synthesis of methylglyoxal via hydrolysis in the presence of H2SO4.It was used to investigate the effects of methylglyoxal-mediated glycation on the structure, thermal stability and enzyme activity of yeast enolase in vivo.

Specifications

Synonyme

P1264 | NSC 50127 | NSC50127 | NSC-50127 | FT-0606125 | 1,1-bis(methyloxy)-2-propanone | Methylglyoxal 1,1-dimethyl acetal pound>>2-Propanone, 1,1-dimethoxy- | MFCD00008758 | Pyruvaldehyde-1-dimethyl acetal | Methylglyoxal 1,1-dimethyl acetal, >=97% | J-5

Spezifikationen & Reinheit

≥97%(GC)

Storage

Argon charged,Room temperature

Verschickt in

Normal

Reinheit

≥97%(GC)

Namen und Kennungen

• Pubchem Sid: 488185892
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185892
• Kanonisches Lächeln: CC(=O)C(OC)OC
• IUPAC Name: 1,1-dimethoxypropan-2-one
• InChIKey: ULVSHNOGEVXRDR-UHFFFAOYSA-N
• INCHI: 1S/C5H10O3/c1-4(6)5(7-2)8-3/h5H,1-3H3
• Isomere SMILES: CC(=O)C(OC)OC
• WGK Deutschland: 1
• PubChem CID: 80650
• UN-Nummer: 1224
• Verpackungsgruppe: III
• Molekulargewicht: 118.13
• Beilstein: 1(4)3631
• Reaxy-Rn: 1560557

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Carbonyl compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Ketones
• Alternative Parents: Acetals Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ketone - Acetal - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol.
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water. 350 g/L at 20°C.
• Empfindlichkeit: Light Sensitive,Air Sensitive
• Brechungsindex: 1.398
• Flammpunkt (°F): 93 °F
• Flammpunkt (°C): 34 °C
• Siedepunkt (°C): 143-147 °C
• Molekulargewicht: 118.130 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 118.063 Da
• Monoisotopic Mass: 118.063 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 75.700
• 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

Referenzen

1. Jifan Li, Duo Li, Chun-Ling Liu, Chunli Xu, Wen-Sheng Dong.  (2019)  The conversion of glycerol to methyl lactate catalyzed by tin-exchanged montmorillonite-supported gold catalysts.  JOURNAL OF CHEMICAL TECHNOLOGY AND BIOTECHNOLOGY,  94  (6): (1958-1967).  [PMID:] [10.1002/jctb.5979]

Häufig gestellte Fragen

What is the purity of this product, and how is it determined?

This product is supplied at ≥97% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 6342-56-9, the molecular formula is C5H10O3, and the molecular weight is 118.13 g/mol. InChIKey ULVSHNOGEVXRDR-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.