Acetone azine - ≥95% , CAS No.627-70-3

CAS: 627-70-3 Cat. No.: A340946 Summenformel: C₆H₁₂N₂ Molekulargewicht: 112.17 EG-Nummer: 211-009-6

GRADE & PURITY ≥95%

Synonyms

1,1,4,4-TETRAMETHYL-2,3-DIAZABUTA-1,3-DIENE | Dimethyl ketazine | Acetone ketazine | 2-Propanone 2-(1-methylethylidene)hydrazone | Acetazine

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Synonyme

1,1,4,4-TETRAMETHYL-2,3-DIAZABUTA-1,3-DIENE | Dimethyl ketazine | Acetone ketazine | 2-Propanone 2-(1-methylethylidene)hydrazone | Acetazine

Spezifikationen & Reinheit

≥95%

Storage

Room temperature,Desiccated

Verschickt in

Normal

Reinheit

≥95%

Namen und Kennungen

• Pubchem Sid: 504755342
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504755342
• Kanonisches Lächeln: CC(=NN=C(C)C)C
• IUPAC Name: N-(propan-2-ylideneamino)propan-2-imine
• InChIKey: PFLUPZGCTVGDLV-UHFFFAOYSA-N
• INCHI: 1S/C6H12N2/c1-5(2)7-8-6(3)4/h1-4H3
• Isomere SMILES: CC(=NN=C(C)C)C
• Molekulargewicht: 112.17
• Reaxy-Rn: 956583
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=956583&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds
      • Subclass Hydrazines and derivatives
        • Ebene5 Azines
          • Ebene6 Ketazines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Hydrazines and derivatives
• Intermediate Tree Nodes: Azines
• Direct Parent: Ketazines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ketazine - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as ketazines. These are azines of ketones containing a moiety with the formula R2C=NN=CR2.
• 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

• Empfindlichkeit: Moisture sensitive
• Brechungsindex: n20/D 1.454 (lit.)
• Siedepunkt (°C): 133° C at 763 mmHg
• Schmelzpunkt (°C): -125° C
• Molekulargewicht: 112.170 g/mol
• XLogP3: 0.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 112.1 Da
• Monoisotopic Mass: 112.1 Da
• Topological Polar Surface Area: 24.700 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 98.500
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

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 627-70-3, the molecular formula is C6H12N2, and the molecular weight is 112.17 g/mol. InChIKey PFLUPZGCTVGDLV-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.