Cas no 70782-27-3 (1-Pyrenamine, N,N-diphenyl-)

1-Pyrenamine, N,N-diphenyl- structure
1-Pyrenamine, N,N-diphenyl- structure
Product Name:1-Pyrenamine, N,N-diphenyl-
CAS No:70782-27-3
MF:C28H19N
MW:369.457166910172
CID:546692
PubChem ID:15376223
Update Time:2025-04-19

1-Pyrenamine, N,N-diphenyl- Chemical and Physical Properties

Names and Identifiers

    • 1-Pyrenamine, N,N-diphenyl-
    • N,N-diphenylpyren-1-amine
    • 70782-27-3
    • diphenylpyrenylamine
    • DTXSID30572164
    • SCHEMBL133492
    • Inchi: 1S/C28H19N/c1-3-10-23(11-4-1)29(24-12-5-2-6-13-24)26-19-17-22-15-14-20-8-7-9-21-16-18-25(26)28(22)27(20)21/h1-19H
    • InChI Key: ZSLFSAHSXHFESK-UHFFFAOYSA-N
    • SMILES: N(C1C=CC=CC=1)(C1C=CC=CC=1)C1=CC=C2C=CC3=CC=CC4=CC=C1C2=C43

Computed Properties

  • Exact Mass: 369.15187
  • Monoisotopic Mass: 369.151749610g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 3
  • Complexity: 527
  • 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: 8.3
  • Topological Polar Surface Area: 3.2?2

Experimental Properties

  • PSA: 3.24
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