Cas no 6134-66-3 (Ethyl 2,2-dichloro-3-oxobutanoate)

Ethyl 2,2-dichloro-3-oxobutanoate structure
6134-66-3 structure
Product Name:Ethyl 2,2-dichloro-3-oxobutanoate
CAS No:6134-66-3
MF:C6H8Cl2O3
MW:199.031920433044
MDL:MFCD00129136
CID:516394
PubChem ID:80217
Update Time:2025-04-19

Ethyl 2,2-dichloro-3-oxobutanoate Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid,2,2-dichloro-3-oxo-, ethyl ester
    • Ethyl 2,2-dichloro-3-oxobutanoate
    • Ethyl 2,2-dichloroacetoacetate
    • Butanoic acid, 2,2-dichloro-3-oxo-, ethyl ester
    • Acetoacetic acid, 2,2-dichloro-, ethyl ester
    • C6H8Cl2O3
    • BLLMZKROLCVGEC-UHFFFAOYSA-N
    • 6685AE
    • Ethyl 2,2-dichloro-3-oxobutanoate #
    • NE11267
    • 2,2-Dichloroacetoacetic acid ethyl ester
    • Ethyl .alpha.,.alpha.-dichloroacetoacetate
    • ST2402
    • 6134-66-3
    • MFCD00129136
    • CS-W010521
    • SCHEMBL3314455
    • DTXSID00210248
    • D78296
    • DA-34389
    • AKOS015999872
    • Ethyl 2 pound not2-dichloro-3-oxobutanoate
    • Ethyl2,2-dichloro-3-oxobutanoate
    • AS-60135
    • EINECS 228-104-3
    • 2,2-dichloro-acetoacetic acid ethyl ester
    • EN300-140088
    • DTXCID00132739
    • Ethyl alpha,alpha-dichloroacetoacetate
    • MDL: MFCD00129136
    • Inchi: 1S/C6H8Cl2O3/c1-3-11-5(10)6(7,8)4(2)9/h3H2,1-2H3
    • InChI Key: BLLMZKROLCVGEC-UHFFFAOYSA-N
    • SMILES: ClC(C(C)=O)(C(=O)OCC)Cl

Computed Properties

  • Exact Mass: 197.98514
  • Monoisotopic Mass: 197.98505
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 4
  • Complexity: 177
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 43.4
  • XLogP3: 1.6

Experimental Properties

  • Density: 1.2920
  • Boiling Point: 203.6℃ at 760 mmHg
  • Flash Point: 77°C
  • Refractive Index: 1.4492 (estimate)
  • PSA: 43.37
  • LogP: 1.31240

Ethyl 2,2-dichloro-3-oxobutanoate Security Information

  • Hazardous Material transportation number:2920
  • PackingGroup:

Ethyl 2,2-dichloro-3-oxobutanoate Pricemore >>

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Ethyl 2,2-dichloro-3-oxobutanoate Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Chlorine
Reference
Chlorination of acetylacetone, acetoacetic and malonic ethyl esters
Amriev, R. A.; Velichko, F. K.; Abdulkina, Z. A., Zhurnal Prikladnoi Khimii (Sankt-Peterburg, 1985, 58(11), 2504-8

Ethyl 2,2-dichloro-3-oxobutanoate Raw materials

Ethyl 2,2-dichloro-3-oxobutanoate Preparation Products

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