Cas no 74858-28-9 (1,4,2-Dioxaphosphepane, 2-(2-chloroethoxy)-, 2-oxide)

1,4,2-Dioxaphosphepane, 2-(2-chloroethoxy)-, 2-oxide structure
74858-28-9 structure
Product Name:1,4,2-Dioxaphosphepane, 2-(2-chloroethoxy)-, 2-oxide
CAS No:74858-28-9
MF:C6H12ClO4P
MW:214.583842277527
CID:540406
PubChem ID:12585585
Update Time:2025-04-19

1,4,2-Dioxaphosphepane, 2-(2-chloroethoxy)-, 2-oxide Chemical and Physical Properties

Names and Identifiers

    • 1,4,2-Dioxaphosphepane, 2-(2-chloroethoxy)-, 2-oxide
    • 2-(2-chloroethoxy)-1,4,2λ<sup>5</sup>-dioxaphosphepane 2-oxide
    • DTXSID80503428
    • 2-(2-Chloroethoxy)-1,4,2lambda~5~-dioxaphosphepan-2-one
    • 74858-28-9
    • Inchi: 1S/C6H12ClO4P/c7-2-5-11-12(8)6-9-3-1-4-10-12/h1-6H2
    • InChI Key: RRQNIMGIUKZOKP-UHFFFAOYSA-N
    • SMILES: ClCCOP1(COCCCO1)=O

Computed Properties

  • Exact Mass: 214.0161736g/mol
  • Monoisotopic Mass: 214.0161736g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 175
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.1
  • Topological Polar Surface Area: 44.8?2

Experimental Properties

  • PSA: 54.57000
  • LogP: 1.82930
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