Cas no 104-69-8 (1,3-Propanediamine,N1,N3-diphenyl-)

1,3-Propanediamine,N1,N3-diphenyl- structure
104-69-8 structure
Product Name:1,3-Propanediamine,N1,N3-diphenyl-
CAS No:104-69-8
MF:C15H18N2
MW:226.316823482513
CID:168990
PubChem ID:66916
Update Time:2025-04-19

1,3-Propanediamine,N1,N3-diphenyl- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Propanediamine,N1,N3-diphenyl-
    • N,N'-diphenylpropane-1,3-diamine
    • N,N'-diphenyl-1,3-Propanediamine
    • 1,3-Propanediamine, N,N'-diphenyl-
    • CHEMBL1526915
    • n,n'-diphenyl-1,3-diaminopropane
    • 1,3-Bis(anilino)propane
    • YJ3D396JXV
    • NS00023312
    • HMS2279P22
    • N,N/'-Diphenylpropane-1,3-diamine
    • SMR000074346
    • (3-anilinopropyl)phenylamine
    • SCHEMBL2065279
    • EINECS 203-228-0
    • DTXSID7059301
    • 1,3-dianilinopropane
    • N1,N3-DIPHENYLPROPANE-1,3-DIAMINE
    • UNII-YJ3D396JXV
    • MLS000063133
    • CS-0097195
    • 1,3-Propanediamine, N1,N3-diphenyl-
    • 104-69-8
    • HMS1591N03
    • 1,3-Bis-phenylaminopropan
    • Inchi: 1S/C15H18N2/c1-3-8-14(9-4-1)16-12-7-13-17-15-10-5-2-6-11-15/h1-6,8-11,16-17H,7,12-13H2
    • InChI Key: JQMRSZJEVQNIPB-UHFFFAOYSA-N
    • SMILES: N(C1C=CC=CC=1)CCCNC1C=CC=CC=1

Computed Properties

  • Exact Mass: 226.14714
  • Monoisotopic Mass: 226.147
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 6
  • Complexity: 161
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3.9
  • Topological Polar Surface Area: 24.1A^2

Experimental Properties

  • Density: 1.099
  • Boiling Point: 424.3°Cat760mmHg
  • Flash Point: 274.2°C
  • Refractive Index: 1.641
  • PSA: 24.06
  • LogP: 3.74670

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