Cas no 54231-39-9 (2,3-Pyridinediamine, N,N'-bis(phenylmethyl)-)

2,3-Pyridinediamine, N,N'-bis(phenylmethyl)- structure
54231-39-9 structure
Product Name:2,3-Pyridinediamine, N,N'-bis(phenylmethyl)-
CAS No:54231-39-9
MF:C19H19N3
MW:289.374264001846
CID:1588016
PubChem ID:10446901
Update Time:2025-04-21

2,3-Pyridinediamine, N,N'-bis(phenylmethyl)- Chemical and Physical Properties

Names and Identifiers

    • 2,3-Pyridinediamine, N,N'-bis(phenylmethyl)-
    • 54231-39-9
    • 2,3-dibenzylaminopyridine
    • N2,N3-Bis(phenylmethyl)-2,3-pyridinediamine
    • DTXSID001264308
    • Inchi: 1S/C19H19N3/c1-3-8-16(9-4-1)14-21-18-12-7-13-20-19(18)22-15-17-10-5-2-6-11-17/h1-13,21H,14-15H2,(H,20,22)
    • InChI Key: VMRFOCAOHVRGAD-UHFFFAOYSA-N
    • SMILES: N(CC1C=CC=CC=1)C1=CC=CN=C1NCC1C=CC=CC=1

Computed Properties

  • Exact Mass: 289.15807
  • Monoisotopic Mass: 289.157897619g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 6
  • Complexity: 295
  • 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: 4.1
  • Topological Polar Surface Area: 37?2

Experimental Properties

  • PSA: 36.95
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