Cas no 53455-06-4 (Thianthrene, 2-bromo-)

Thianthrene, 2-bromo- structure
Thianthrene, 2-bromo- structure
Product Name:Thianthrene, 2-bromo-
CAS No:53455-06-4
MF:C12H7BrS2
MW:295.217979669571
CID:357210
PubChem ID:13213122
Update Time:2025-04-19

Thianthrene, 2-bromo- Chemical and Physical Properties

Names and Identifiers

    • Thianthrene, 2-bromo-
    • 2-bromothianthrene
    • ZB0232
    • 53455-06-4
    • SCHEMBL14247841
    • A50067
    • QFQJCTUAPQREMT-UHFFFAOYSA-N
    • DTXSID90528425
    • CS-0166704
    • MFCD00093037
    • Inchi: 1S/C12H7BrS2/c13-8-5-6-11-12(7-8)15-10-4-2-1-3-9(10)14-11/h1-7H
    • InChI Key: QFQJCTUAPQREMT-UHFFFAOYSA-N
    • SMILES: BrC1C=CC2=C(C=1)SC1C=CC=CC=1S2

Computed Properties

  • Exact Mass: 293.91731
  • Monoisotopic Mass: 293.91726g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 0
  • Complexity: 234
  • 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: 5.3
  • Topological Polar Surface Area: 50.6?2

Experimental Properties

  • PSA: 0

Thianthrene, 2-bromo- Pricemore >>

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