Cas no 40054-08-8 (2-naphthalen-1-yl-4,5-dihydro-1,3-oxazole)

2-naphthalen-1-yl-4,5-dihydro-1,3-oxazole structure
40054-08-8 structure
Product Name:2-naphthalen-1-yl-4,5-dihydro-1,3-oxazole
CAS No:40054-08-8
MF:C13H11NO
MW:197.232543230057
CID:925228
PubChem ID:293474
Update Time:2025-04-19

2-naphthalen-1-yl-4,5-dihydro-1,3-oxazole Chemical and Physical Properties

Names and Identifiers

    • 2-naphthalen-1-yl-4,5-dihydro-1,3-oxazole
    • CTK1D7411; NSC160089; SureCN7059491; AC1L6K90; 2-(1-naphthyl)oxazoline; AR-1C9567; 2-[1]naphthyl-4,5-dihydro-oxazole; 2-[1]Naphthyl-4,5-dihydro-oxazol; 2-naphthalen-1-yl-4,5-dihydro-oxazole; AC1Q4UH7; 2-(1-naphthyl)-2-oxazoline; 2-(naphthalen-1-yl)-4,5-dihydro-1,3-oxazole;
    • DTXSID60303685
    • NSC-160089
    • 40054-08-8
    • NSC160089
    • naphthyloxazoline
    • SCHEMBL7059491
    • Inchi: 1S/C13H11NO/c1-2-6-11-10(4-1)5-3-7-12(11)13-14-8-9-15-13/h1-7H,8-9H2
    • InChI Key: ZGMKMNLVGRQPMO-UHFFFAOYSA-N
    • SMILES: O1CCN=C1C1=CC=CC2C=CC=CC1=2

Computed Properties

  • Exact Mass: 197.084
  • Monoisotopic Mass: 197.084
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 261
  • 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: 2.7
  • Topological Polar Surface Area: 21.6?2

Experimental Properties

  • Density: 1.17
  • Boiling Point: 366.5°C at 760 mmHg
  • Flash Point: 142.4°C
  • Refractive Index: 1.625

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