Cas no 58076-34-9 (Benzenesulfonylchloride, 4-(dodecyloxy)-)

Benzenesulfonylchloride, 4-(dodecyloxy)- structure
58076-34-9 structure
Product Name:Benzenesulfonylchloride, 4-(dodecyloxy)-
CAS No:58076-34-9
MF:C18H29ClO3S
MW:360.93906378746
CID:377405
PubChem ID:93935
Update Time:2025-04-19

Benzenesulfonylchloride, 4-(dodecyloxy)- Chemical and Physical Properties

Names and Identifiers

    • 4-dodecoxybenzenesulfonyl chloride
    • Benzenesulfonylchloride, 4-(dodecyloxy)-
    • p-(dodecyloxy)benzenesulphonyl chloride
    • 4-(dodecyloxy)benzenesulfonyl chloride
    • EINECS 261-099-6
    • p-dodecyloxybenzenesulfonyl chloride
    • p-(Dodecyloxy)benzenesulfonyl chloride
    • Q8B3MY9VEE
    • 58076-34-9
    • Benzenesulfonyl chloride, 4-(dodecyloxy)-
    • NS00033855
    • 4-dodecyloxybenzenesulfonyl chloride
    • DTXSID1074628
    • SCHEMBL7766693
    • Inchi: 1S/C18H29ClO3S/c1-2-3-4-5-6-7-8-9-10-11-16-22-17-12-14-18(15-13-17)23(19,20)21/h12-15H,2-11,16H2,1H3
    • InChI Key: VHNTZBNCKFRVAD-UHFFFAOYSA-N
    • SMILES: ClS(C1C=CC(=CC=1)OCCCCCCCCCCCC)(=O)=O

Computed Properties

  • Exact Mass: 360.15277
  • Monoisotopic Mass: 360.1525937g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 13
  • Complexity: 370
  • 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: 7.6
  • Topological Polar Surface Area: 51.8?2

Experimental Properties

  • PSA: 43.37
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