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

CAS: 2157-56-4 Cat. No.: P160246 Fórmula: C₅H₁₀N₂O₂ Peso molecular: 130.15 Beilstein Registry Number: 1(3)3123 Número CE: 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

Sinónimos

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

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

488186857

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488186857

Sorrisos canónicos

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

SMILES isoméricas

CC(=NO)CC(=NO)C

PubChem CID

94762

Peso molecular

130.15

Beilstein

1(3)3123

Reaxy-Rn

5245267

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: 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
• Descrição: 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

Propriedades químicas e físicas

• Solubilidade: Soluble in water; Soluble in Ether,Ethanol
• Ponto de fusão (°C): 142-151℃
• Peso molecular: 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

Perguntas frequentes

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.