Cas no 21226-31-3 (N-(2-bromophenyl)benzenesulfonamide)

N-(2-bromophenyl)benzenesulfonamide structure
21226-31-3 structure
Product Name:N-(2-bromophenyl)benzenesulfonamide
CAS No:21226-31-3
MF:C12H10BrNO2S
MW:312.182301044464
CID:911323
PubChem ID:262258
Update Time:2025-04-19

N-(2-bromophenyl)benzenesulfonamide Chemical and Physical Properties

Names and Identifiers

    • N-(2-bromophenyl)benzenesulfonamide
    • 2-bromo-N-benzenesulfonylaniline
    • AC1L673F
    • AC1Q2707
    • AH-034
    • ARONIS000671
    • benzenesulfonic acid-(2-bromo-anilide)
    • Benzolsulfonsaeure-(2-brom-anilid)
    • N-(2-Bromo-phenyl)-benzenesulfonamide
    • NSC95709
    • o-bromo-N-(benzenesulfonyl)aniline
    • o-bromo-N-benzenesulfonylaniline
    • SureCN5731180
    • NSC 95709
    • NSC-95709
    • DTXSID40294284
    • LBMJQGDIAXELFQ-UHFFFAOYSA-N
    • starbld0006358
    • 2'-bromobenzenesulfonanilide
    • STK086082
    • MFCD00541883
    • AKOS000182735
    • DA-08242
    • AH-034/04668019
    • Z45619893
    • 21226-31-3
    • (2-bromophenyl)(phenylsulfonyl)amine
    • SCHEMBL5731180
    • Cambridge id 5112617
    • Inchi: 1S/C12H10BrNO2S/c13-11-8-4-5-9-12(11)14-17(15,16)10-6-2-1-3-7-10/h1-9,14H
    • InChI Key: LBMJQGDIAXELFQ-UHFFFAOYSA-N
    • SMILES: BrC1C=CC=CC=1NS(C1C=CC=CC=1)(=O)=O

Computed Properties

  • Exact Mass: 310.9616
  • Monoisotopic Mass: 310.96156g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 333
  • 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: 2.7
  • Topological Polar Surface Area: 54.6?2

Experimental Properties

  • PSA: 46.17
  • LogP: 4.40370
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