Cas no 3365-88-6 ([1,1'-Biphenyl]-3-sulfonicacid, 4-amino-)

[1,1'-Biphenyl]-3-sulfonicacid, 4-amino- structure
3365-88-6 structure
Product Name:[1,1'-Biphenyl]-3-sulfonicacid, 4-amino-
CAS No:3365-88-6
MF:C12H11NO3S
MW:249.285641908646
CID:295449
PubChem ID:14047813
Update Time:2025-04-19

[1,1'-Biphenyl]-3-sulfonicacid, 4-amino- Chemical and Physical Properties

Names and Identifiers

    • [1,1'-Biphenyl]-3-sulfonicacid, 4-amino-
    • 3-Biphenylsulfonicacid, 4-amino- (7CI,8CI)
    • 4-amino-biphenyl-3-sulfonic acid
    • 4-AMINOBIPHENYL-3-SULFONIC ACID
    • 4-Amino-biphenyl-3-sulfonsaeure
    • 4-Amino-diphenyl-sulfonsaeure-(3)
    • AG-F-13769
    • AGN-PC-0008QV
    • CTK1C1048
    • 4-Amino[1,1'-biphenyl]-3-sulfonic acid
    • 3365-88-6
    • SCHEMBL5973210
    • DTXSID90555019
    • Inchi: 1S/C12H11NO3S/c13-11-7-6-10(8-12(11)17(14,15)16)9-4-2-1-3-5-9/h1-8H,13H2,(H,14,15,16)
    • InChI Key: SCMXWXFLUFQKOW-UHFFFAOYSA-N
    • SMILES: S(C1C(=CC=C(C2C=CC=CC=2)C=1)N)(=O)(=O)O

Computed Properties

  • Exact Mass: 249.04603
  • Monoisotopic Mass: 249.04596439g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 343
  • 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: 2.2
  • Topological Polar Surface Area: 88.8?2

Experimental Properties

  • PSA: 80.39

[1,1'-Biphenyl]-3-sulfonicacid, 4-amino- Related Literature

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