Cas no 79515-58-5 (Phenyl 2-ethoxybenzoate)

Phenyl 2-ethoxybenzoate structure
Phenyl 2-ethoxybenzoate structure
Product Name:Phenyl 2-ethoxybenzoate
CAS No:79515-58-5
MF:C15H14O3
MW:242.269864559174
CID:984737
PubChem ID:347608
Update Time:2025-04-20

Phenyl 2-ethoxybenzoate Chemical and Physical Properties

Names and Identifiers

    • phenyl 2-ethoxybenzoate
    • AC1L87PE
    • NSC406386
    • NSC-406386
    • SureCN538561
    • SCHEMBL538561
    • DTXSID00324319
    • AKOS003498202
    • 79515-58-5
    • FT-0722788
    • DA-02718
    • Phenyl 2-ethoxybenzoate
    • Inchi: 1S/C15H14O3/c1-2-17-14-11-7-6-10-13(14)15(16)18-12-8-4-3-5-9-12/h3-11H,2H2,1H3
    • InChI Key: YBTFWFBOFYWTAG-UHFFFAOYSA-N
    • SMILES: O(CC)C1C=CC=CC=1C(=O)OC1C=CC=CC=1

Computed Properties

  • Exact Mass: 242.09432
  • Monoisotopic Mass: 242.094294304g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 259
  • 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: 3.5
  • Topological Polar Surface Area: 35.5

Experimental Properties

  • PSA: 35.53
  • LogP: 3.30450
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