Cas no 16442-10-7 (Benzoic acid,2,6-dichloro-, 1,1'-anhydride)

Benzoic acid,2,6-dichloro-, 1,1'-anhydride structure
16442-10-7 structure
Product Name:Benzoic acid,2,6-dichloro-, 1,1'-anhydride
CAS No:16442-10-7
MF:C14H6Cl4O3
MW:364.007640361786
CID:142401
PubChem ID:85423
Update Time:2025-04-19

Benzoic acid,2,6-dichloro-, 1,1'-anhydride Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,2,6-dichloro-, 1,1'-anhydride
    • 2,6-dichlorobenzoic anhydride
    • Bis(2,6-dichlorobenzoic) anhydride
    • 16442-10-7
    • SCHEMBL5703139
    • EINECS 240-494-7
    • DTXSID50936946
    • AKOS024430614
    • NS00053056
    • Inchi: 1S/C14H6Cl4O3/c15-7-3-1-4-8(16)11(7)13(19)21-14(20)12-9(17)5-2-6-10(12)18/h1-6H
    • InChI Key: CGDWAVBBLJTVDO-UHFFFAOYSA-N
    • SMILES: ClC1C=CC=C(C=1C(=O)OC(C1C(=CC=CC=1Cl)Cl)=O)Cl

Computed Properties

  • Exact Mass: 361.90728
  • Monoisotopic Mass: 361.907105g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 348
  • 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: 5.7
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37

Benzoic acid,2,6-dichloro-, 1,1'-anhydride Related Literature

  • 1. Design and preparation of serine–threonine protein phosphatase inhibitors based upon the nodularin and microcystin toxin structures. Part 3
    Kerri L. Webster,Antony B. Maude,Michael E. O'Donnell,Amit P. Mehrotra,David Gani J. Chem. Soc. Perkin Trans. 1 2001 1673
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