Cas no 85098-65-3 (Acetic acid,2-[(methoxythioxomethyl)thio]-, sodium salt (1:1))

Acetic acid,2-[(methoxythioxomethyl)thio]-, sodium salt (1:1) structure
85098-65-3 structure
Product Name:Acetic acid,2-[(methoxythioxomethyl)thio]-, sodium salt (1:1)
CAS No:85098-65-3
MF:C4H5NaO3S2
MW:188.200469732285
CID:725975
Update Time:2026-04-29

Acetic acid,2-[(methoxythioxomethyl)thio]-, sodium salt (1:1) Chemical and Physical Properties

Names and Identifiers

    • Acetic acid,2-[(methoxythioxomethyl)thio]-, sodium salt (1:1)
    • sodium [(methoxythioxomethyl)thio]acetate
    • sodium,2-methoxycarbothioylsulfanylacetate

Computed Properties

  • Exact Mass: 187.95778
  • Monoisotopic Mass: 187.95778
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 128
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 107

Experimental Properties

  • Boiling Point: 301.8°C at 760 mmHg
  • Flash Point: 136.3°C
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