Cas no 82696-21-7 (1,3,5-Triazine-2(1H)-thione, tetrahydro-3,5-dimethyl-)

1,3,5-Triazine-2(1H)-thione, tetrahydro-3,5-dimethyl- structure
82696-21-7 structure
Product Name:1,3,5-Triazine-2(1H)-thione, tetrahydro-3,5-dimethyl-
CAS No:82696-21-7
MF:C5H11N3S
MW:145.225939035416
CID:687250
PubChem ID:20461145
Update Time:2025-04-19

1,3,5-Triazine-2(1H)-thione, tetrahydro-3,5-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 1,3,5-Triazine-2(1H)-thione, tetrahydro-3,5-dimethyl-
    • 1,5-dimethyl-1,3,5-triazinane-2-thione
    • 1,5-dimethyl-3,4,5,6-tetrahydro-s-triazin-2(1H)thione
    • 82696-21-7
    • DEMKIWPDKUNMBU-UHFFFAOYSA-N
    • DTXSID70607464
    • AKOS006381550
    • SCHEMBL11084072
    • Inchi: 1S/C5H11N3S/c1-7-3-6-5(9)8(2)4-7/h3-4H2,1-2H3,(H,6,9)
    • InChI Key: DEMKIWPDKUNMBU-UHFFFAOYSA-N
    • SMILES: S=C1NCN(C)CN1C

Computed Properties

  • Exact Mass: 145.06736854g/mol
  • Monoisotopic Mass: 145.06736854g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 125
  • 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: 0.2
  • Topological Polar Surface Area: 50.6?2

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