Cas no 33498-62-3 (Phenanthrene,9-methyl-10-phenyl-)

Phenanthrene,9-methyl-10-phenyl- structure
33498-62-3 structure
Product Name:Phenanthrene,9-methyl-10-phenyl-
CAS No:33498-62-3
MF:C21H16
MW:268.351745605469
CID:312643
PubChem ID:334548
Update Time:2025-04-19

Phenanthrene,9-methyl-10-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Phenanthrene,9-methyl-10-phenyl-
    • 9-METHYL-10-PHENYLPHENANTHRENE
    • Phenanthrene, 9-methyl-10-phenyl
    • NEOHESPERIDINDIHYDROCHALCONEHYDRATE
    • NSC340037
    • VASMZEZNNVGPBU-UHFFFAOYSA-N
    • NSC-340037
    • DTXSID80319122
    • 33498-62-3
    • Inchi: 1S/C21H16/c1-15-17-11-5-6-12-18(17)19-13-7-8-14-20(19)21(15)16-9-3-2-4-10-16/h2-14H,1H3
    • InChI Key: VASMZEZNNVGPBU-UHFFFAOYSA-N
    • SMILES: C1(C2C=CC=CC=2)=C(C)C2C=CC=CC=2C2C=CC=CC1=2

Computed Properties

  • Exact Mass: 268.12528
  • Monoisotopic Mass: 268.125
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 1
  • Complexity: 340
  • 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: 6.4
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 1.121
  • Boiling Point: 413.5°C at 760 mmHg
  • Flash Point: 198.2°C
  • Refractive Index: 1.689
  • PSA: 0
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