Cas no 62325-31-9 (Phenanthrene, 2,7-diiodo-)

Phenanthrene, 2,7-diiodo- structure
Phenanthrene, 2,7-diiodo- structure
Product Name:Phenanthrene, 2,7-diiodo-
CAS No:62325-31-9
MF:C14H8I2
MW:430.022268295288
CID:449255
PubChem ID:12325939
Update Time:2025-04-19

Phenanthrene, 2,7-diiodo- Chemical and Physical Properties

Names and Identifiers

    • Phenanthrene, 2,7-diiodo-
    • 2,7-diiodophenanthrene
    • DTXSID90489562
    • SCHEMBL1419169
    • 62325-31-9
    • Inchi: 1S/C14H8I2/c15-11-3-5-13-9(7-11)1-2-10-8-12(16)4-6-14(10)13/h1-8H
    • InChI Key: SUFSPCXKCJYCKL-UHFFFAOYSA-N
    • SMILES: IC1C=CC2C(C=1)=CC=C1C=C(C=CC=21)I

Computed Properties

  • Exact Mass: 429.87064
  • Monoisotopic Mass: 429.87155g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 227
  • 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: 6.1
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 2.13
  • Boiling Point: 478.2 °C at 760 mmHg
  • Flash Point: 261.8 °C
  • PSA: 0
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