Cas no 70998-42-4 (Benzamide, 4-amino-N-(4-bromophenyl)-)

Benzamide, 4-amino-N-(4-bromophenyl)- structure
70998-42-4 structure
Product Name:Benzamide, 4-amino-N-(4-bromophenyl)-
CAS No:70998-42-4
MF:C13H11BrN2O
MW:291.143242120743
CID:546282
PubChem ID:3329362
Update Time:2025-04-19

Benzamide, 4-amino-N-(4-bromophenyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzamide, 4-amino-N-(4-bromophenyl)-
    • 4-amino-N-(4-bromophenyl)benzamide
    • DTXSID90391510
    • 70998-42-4
    • F70021
    • AKOS000140546
    • Inchi: 1S/C13H11BrN2O/c14-10-3-7-12(8-4-10)16-13(17)9-1-5-11(15)6-2-9/h1-8H,15H2,(H,16,17)
    • InChI Key: JAANJKPYZTUMJB-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1)NC(C1C=CC(=CC=1)N)=O

Computed Properties

  • Exact Mass: 290.00553
  • Monoisotopic Mass: 290.00548g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 256
  • 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: 2.6
  • Topological Polar Surface Area: 55.1?2

Experimental Properties

  • PSA: 55.12
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