2,4-Pentanedione Dioxime - ≥98% , CAS No.2157-56-4

CAS: 2157-56-4 Cat. No.: P160246 Summenformel: C₅H₁₀N₂O₂ Molekulargewicht: 130.15 Beilstein Registry Number: 1(3)3123 EG-Nummer: 218-472-3 PubChem CID: 94762

GRADE & PURITY ≥98%

Synonyms

Acetylacetone dioxime | 2,4-Pentanedione, dioxime | 2,4-Pentanedione dioxime | FT-0621821 | DTXSID5062219 | D78360 | N-(4-hydroxyiminopentan-2-ylidene)hydroxylamine

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

Acetylacetone dioxime | 2,4-Pentanedione, dioxime | 2,4-Pentanedione dioxime | FT-0621821 | DTXSID5062219 | D78360 | N-(4-hydroxyiminopentan-2-ylidene)hydroxylamine

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488186857
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186857
• Kanonisches Lächeln: CC(=NO)CC(=NO)C
• IUPAC Name: N-(4-hydroxyiminopentan-2-ylidene)hydroxylamine
• InChIKey: WBRYLZHYOFBTPD-UHFFFAOYSA-N
• INCHI: 1S/C5H10N2O2/c1-4(6-8)3-5(2)7-9/h8-9H,3H2,1-2H3
• Isomere SMILES: CC(=NO)CC(=NO)C
• PubChem CID: 94762
• Molekulargewicht: 130.15
• Beilstein: 1(3)3123
• Reaxy-Rn: 5245267

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Oximes

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Oximes
• Intermediate Tree Nodes: Not available
• Direct Parent: Ketoximes
• Alternative Parents: Organic oxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ketoxime - Organic oxygen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as ketoximes. These are organic compounds with the general formula RC(R')=NOH (R,R' = organyl).
• 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; Soluble in Ether,Ethanol
• Schmelzpunkt (°C): 142-151℃
• Molekulargewicht: 130.150 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 130.074 Da
• Monoisotopic Mass: 130.074 Da
• Topological Polar Surface Area: 65.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 124.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 2
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1

Häufig gestellte Fragen

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 room temperature.

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 2157-56-4, the molecular formula is C5H10N2O2, and the molecular weight is 130.15 g/mol. InChIKey WBRYLZHYOFBTPD-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.