Cas no 52873-25-3 (ethyl 4-chloro-2-hydroxy-benzoate)

ethyl 4-chloro-2-hydroxy-benzoate structure
52873-25-3 structure
Product Name:ethyl 4-chloro-2-hydroxy-benzoate
CAS No:52873-25-3
MF:C9H9ClO3
MW:200.618962049484
CID:1579153
PubChem ID:12548597
Update Time:2025-04-21

ethyl 4-chloro-2-hydroxy-benzoate Chemical and Physical Properties

Names and Identifiers

    • ethyl 4-chloro-2-hydroxy-benzoate
    • benzoic acid, 4-chloro-2-hydroxy-, ethyl ester
    • Ethyl 4-chloro-2-hydroxybenzoate
    • LogP
    • CCA87325
    • AKOS008949019
    • ethyl4-chloro-2-hydroxybenzoate
    • SCHEMBL3304119
    • FTBFROUATIILHB-UHFFFAOYSA-N
    • DA-05174
    • ethyl 4-chlorosalicylate
    • CS-0361559
    • DTXSID701248311
    • 52873-25-3
    • MDL: MFCD12178148
    • Inchi: 1S/C9H9ClO3/c1-2-13-9(12)7-4-3-6(10)5-8(7)11/h3-5,11H,2H2,1H3
    • InChI Key: FTBFROUATIILHB-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(C(=O)OCC)=C(C=1)O

Computed Properties

  • Exact Mass: 200.02407
  • Monoisotopic Mass: 200.0240218g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 184
  • 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: 3.6
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • Density: 1.3
  • Boiling Point: 261.6°C at 760 mmHg
  • Flash Point: 112°C
  • Refractive Index: 1.554
  • PSA: 46.53

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