Cas no 130562-95-7 (Ethyl 2,5-dichlorothiophene-3-carboxylate)

Ethyl 2,5-dichlorothiophene-3-carboxylate structure
130562-95-7 structure
Product Name:Ethyl 2,5-dichlorothiophene-3-carboxylate
CAS No:130562-95-7
MF:C7H6Cl2O2S
MW:225.092339038849
MDL:MFCD06205024
CID:1080462
PubChem ID:14639928
Update Time:2025-04-20

Ethyl 2,5-dichlorothiophene-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2,5-dichlorothiophene-3-carboxylate
    • methyl 2,5-dichlorothiophene-3-carboxylate
    • 3-Thiophenecarboxylic acid, 2,5-dichloro-, ethyl ester
    • MFCD06205024
    • 2,5-dichloro-3-thiophenecarboxylic acid ethyl ester
    • DA-16620
    • SCHEMBL8630782
    • Ethyl2,5-dichlorothiophene-3-carboxylate
    • 130562-95-7
    • AKOS022185756
    • NWRLHZNWNIDWFY-UHFFFAOYSA-N
    • MDL: MFCD06205024
    • Inchi: 1S/C7H6Cl2O2S/c1-2-11-7(10)4-3-5(8)12-6(4)9/h3H,2H2,1H3
    • InChI Key: NWRLHZNWNIDWFY-UHFFFAOYSA-N
    • SMILES: ClC1=C(C(=O)OCC)C=C(S1)Cl

Computed Properties

  • Exact Mass: 223.9465560g/mol
  • Monoisotopic Mass: 223.9465560g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • 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
  • XLogP3: 3.7
  • Topological Polar Surface Area: 54.5?2

Experimental Properties

  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 257.3±35.0 °C at 760 mmHg
  • Flash Point: 109.4±25.9 °C
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

Ethyl 2,5-dichlorothiophene-3-carboxylate Security Information

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