Cas no 64728-23-0 (Benzene, 4-(2-iodoethyl)-1,2-dimethoxy-)

Benzene, 4-(2-iodoethyl)-1,2-dimethoxy- structure
64728-23-0 structure
Product Name:Benzene, 4-(2-iodoethyl)-1,2-dimethoxy-
CAS No:64728-23-0
MF:C10H13IO2
MW:292.113495588303
CID:417592
PubChem ID:597022
Update Time:2025-04-19

Benzene, 4-(2-iodoethyl)-1,2-dimethoxy- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 4-(2-iodoethyl)-1,2-dimethoxy-
    • 4-(2-iodoethyl)-1,2-dimethoxybenzene
    • 2-(3,4-dimethoxyphenyl)-1-iodoethane
    • 3,4-dimethoxyphenyl ethyl iodide
    • SCHEMBL5447780
    • DTXSID20344458
    • 1-(2-Iodoethyl)-3,4-dimethoxybenzene
    • 3,4-Dimethoxyphenethyl iodide
    • 64728-23-0
    • Inchi: 1S/C10H13IO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5-6H2,1-2H3
    • InChI Key: BOBYPEPSZXBOEZ-UHFFFAOYSA-N
    • SMILES: ICCC1C=CC(=C(C=1)OC)OC

Computed Properties

  • Exact Mass: 291.99559
  • Monoisotopic Mass: 291.99603g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 141
  • 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: 3
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • PSA: 18.46
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