Cas no 6455-80-7 (Benzenesulfonamide,4-methyl-N-2H-tetrazol-5-yl-)

Benzenesulfonamide,4-methyl-N-2H-tetrazol-5-yl- structure
6455-80-7 structure
Product Name:Benzenesulfonamide,4-methyl-N-2H-tetrazol-5-yl-
CAS No:6455-80-7
MF:C18H21BrO4
MW:381.260945081711
CID:505339
PubChem ID:2284241
Update Time:2025-04-19

Benzenesulfonamide,4-methyl-N-2H-tetrazol-5-yl- Chemical and Physical Properties

Names and Identifiers

    • Benzenesulfonamide,4-methyl-N-2H-tetrazol-5-yl-
    • 1-bromo-4-[2-[2-(2-ethoxyphenoxy)ethoxy]ethoxy]benzene
    • DTXSID90367755
    • 6455-80-7
    • Inchi: 1S/C18H21BrO4/c1-2-21-17-5-3-4-6-18(17)23-14-12-20-11-13-22-16-9-7-15(19)8-10-16/h3-10H,2,11-14H2,1H3
    • InChI Key: OTAWBJVAXVZADV-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1)OCCOCCOC1C=CC=CC=1OCC

Computed Properties

  • Exact Mass: 380.06233
  • Monoisotopic Mass: 380.062
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 10
  • Complexity: 295
  • 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: 4
  • Topological Polar Surface Area: 36.9?2

Experimental Properties

  • Density: 1.295
  • Boiling Point: 470.8°C at 760 mmHg
  • Flash Point: 196.3°C
  • Refractive Index: 1.55
  • PSA: 36.92
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