Cas no 3402-76-4 (1-phenoxynaphthalene)

1-phenoxynaphthalene structure
1-phenoxynaphthalene structure
Product Name:1-phenoxynaphthalene
CAS No:3402-76-4
MF:C16H12O
MW:220.265884399414
CID:918694
PubChem ID:235584
Update Time:2025-04-19

1-phenoxynaphthalene Chemical and Physical Properties

Names and Identifiers

    • 1-phenoxynaphthalene
    • [1]naphthyl-phenyl ether
    • [1]Naphthyl-phenyl-aether
    • 1-naphthyl phenyl ether
    • 1-Phenoxy-naphthalin
    • AC1L5UPH
    • AC1Q57HA
    • CTK1C5669
    • DABOOAVTBIRGHP-UHFFFAOYSA-
    • Naphthalene, 1-phenoxy-
    • NSC37150
    • phenyl naphthyl ether
    • SureCN441860
    • InChI=1/C16H12O/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12H
    • 3402-76-4
    • Phenyl(1-naphtyl) ether
    • phenoxynaphthalene
    • DTXSID40284408
    • SCHEMBL441860
    • NSC-37150
    • 1-Naphthyl phenyl ether #
    • Inchi: 1S/C16H12O/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12H
    • InChI Key: DABOOAVTBIRGHP-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=CC=1)C1=CC=CC2=CC=CC=C21

Computed Properties

  • Exact Mass: 220.08886
  • Monoisotopic Mass: 220.089
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 232
  • 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: 5.2
  • Topological Polar Surface Area: 9.2?2

Experimental Properties

  • Density: 1.0588 (rough estimate)
  • Melting Point: 55.5°C
  • Boiling Point: 349.5°C (estimate)
  • Flash Point: 166.8°C
  • Refractive Index: 1.5800 (estimate)
  • PSA: 9.23
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