Cas no 607-97-6 (Ethyl-2-ethylacetoacetate)

Ethyl-2-ethylacetoacetate is a versatile ester commonly used as an intermediate in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and fine chemicals. Its structure features both keto and ester functional groups, enabling participation in condensation, alkylation, and Michael addition reactions. The compound offers high reactivity and selectivity, making it valuable for constructing complex molecular frameworks. Its stability under standard conditions and compatibility with various solvents enhance its utility in industrial and laboratory settings. Ethyl-2-ethylacetoacetate is also noted for its role in synthesizing heterocyclic compounds, contributing to its importance in medicinal and materials chemistry applications.
Ethyl-2-ethylacetoacetate structure
Ethyl-2-ethylacetoacetate structure
Product Name:Ethyl-2-ethylacetoacetate
CAS No:607-97-6
MF:C8H14O3
MW:158.194962978363
MDL:MFCD00039898
CID:38777
PubChem ID:79065
Update Time:2026-05-14

Ethyl-2-ethylacetoacetate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2-ethylacetoacetate
    • Ethyl 2-ethyl-3-oxobutanoate:Diethyl acetoacetate
    • Butanoic acid, 2-ethyl-3-oxo-, ethyl ester
    • 2-ETHYLACETOACETIC ACID ETHYL ESTER
    • Ethyl 2-ethyl-3-oxobutanoate
    • Ethylethylacetoacetate
    • 2-Acetylbutyric Acid Ethyl Ester
    • Ethyl 2-Acetylbutyrate
    • 2-Ethyl-3-oxo-butanoic acid ethyl ester
    • Ethyl 2-ethyl-3-ketobutyrate
    • Ethyl alpha-ethylacetoacetate
    • ethyl-2-ethylacetoacetate
    • 2-ethyl-3-oxo-butyric acid ethyl ester
    • Ethyl .alpha.-acetylbutyrate
    • ethyl 2-ethyl-3-oxo-butanoate
    • Ethyl .alpha.-ethylacetoacetate
    • OKANYBNORCUPKZ-UHFFFAOYSA-N
    • Ethyl alpha-acetylbutyrate
    • Ethyl-2-ethylacetoacetate
    • MDL: MFCD00039898
    • Inchi: 1S/C8H14O3/c1-4-7(6(3)9)8(10)11-5-2/h7H,4-5H2,1-3H3
    • InChI Key: OKANYBNORCUPKZ-UHFFFAOYSA-N
    • SMILES: O(C([H])([H])C([H])([H])[H])C(C([H])(C(C([H])([H])[H])=O)C([H])([H])C([H])([H])[H])=O

Computed Properties

  • Exact Mass: 158.09400
  • Monoisotopic Mass: 158.094294
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 5
  • Complexity: 151
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 5
  • XLogP3: 1.3
  • Topological Polar Surface Area: 43.4

Experimental Properties

  • Color/Form: Not available
  • Density: 0.981?g/mL?at 25?°C(lit.)
  • Boiling Point: 87-189?°C/743?mmHg(lit.)
  • Flash Point: Fahrenheit: 156.2 ° f
    Celsius: 69 ° c
  • Refractive Index: n20/D 1.421(lit.)
  • PSA: 43.37000
  • LogP: 1.16470
  • Solubility: Not available

Ethyl-2-ethylacetoacetate Security Information

  • Prompt:warning
  • Signal Word:Warning
  • Hazard Statement: H227
  • Warning Statement: P210-P280-P370+P378-P403+P235-P501
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:1
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S23-S24/25
  • Hazardous Material Identification: Xi
  • Safety Term:S23;S24/25
  • HazardClass:IRRITANT
  • TSCA:Yes
  • Storage Condition:Store at room temperature
  • Risk Phrases:R36/37/38

Ethyl-2-ethylacetoacetate Pricemore >>

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Ethyl-2-ethylacetoacetate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:607-97-6)Ethyl-2-ethylacetoacetate
Order Number:A832890
Stock Status:in Stock
Quantity:500g/1kg
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 15:30
Price ($):162.0/275.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:607-97-6)Ethyl-2-ethylacetoacetate
A832890
Purity:99%/99%
Quantity:500g/1kg
Price ($):162.0/275.0
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