Cas no 4407-40-3 (1,3,5-Triazine,2-chloro-4,6-bis(methylthio)-)

1,3,5-Triazine,2-chloro-4,6-bis(methylthio)- structure
4407-40-3 structure
Product Name:1,3,5-Triazine,2-chloro-4,6-bis(methylthio)-
CAS No:4407-40-3
MF:C5H6ClN3S2
MW:207.704236507416
CID:332101
PubChem ID:20437
Update Time:2025-04-19

1,3,5-Triazine,2-chloro-4,6-bis(methylthio)- Chemical and Physical Properties

Names and Identifiers

    • 1,3,5-Triazine,2-chloro-4,6-bis(methylthio)-
    • 2-chloro-4,6-bis(methylsulfanyl)-1,3,5-triazine
    • 6-chloro-2,4-bis(methylthio)-1,3,5-triazine
    • 2,4-Bis(methylthio)-6-chloro-s-triazine
    • 2,4-dimethylthio-6-chloro-1,3,5-triazine
    • 2,4-Dimethylthio-6-chlor-s-triazin
    • 2-CHLORO-4,6-BIS(METHYLTHIO)-S-TRIAZINE
    • 2-chloro-4,6-bis-methylsulfanyl-[1,3,5]triazine
    • 2-chloro-4,6-dimethylthio-1,3,5-triazine
    • BRN 0880635
    • EINECS 224-555-5
    • s-Triazine, 2,4-bis(methylthio)-6-chloro-
    • 1,5-Triazine, 2-chloro-4,6-bis(methylthio)-
    • 1,3,5-Triazine, 2-chloro-4,6-bis(methylthio)-
    • J2JD2W3LEH
    • 2-Chloro-4,6-bis(methylsulfanyl)-1,3,5-triazine #
    • NSC 221305
    • s-Triazine,4-bis(methylthio)-6-chloro-
    • DTXSID80196031
    • 4407-40-3
    • NS00031388
    • 2,4-Bis(Methylthio)-6-chloro-1,3,5-triazine
    • ZPHLQJFYCYTLLX-UHFFFAOYSA-N
    • s-Triazine, 2-chloro-4,6-bis(methylthio)-
    • NSC221305
    • 5-26-03-00455 (Beilstein Handbook Reference)
    • 2-Chloro-4,6-bis(methylthio)-1,3,5-triazine
    • NSC-221305
    • SCHEMBL383476
    • Inchi： 1S/C5H6ClN3S2/c1-10-4-7-3(6)8-5(9-4)11-2/h1-2H3
    • InChI Key： ZPHLQJFYCYTLLX-UHFFFAOYSA-N
    • SMILES： ClC1=NC(=NC(=N1)SC)SC

Computed Properties

  • Exact Mass: 206.96938
  • Monoisotopic Mass: 206.969
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 114
  • 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
  • Topological Polar Surface Area: 89.3A^2
  • XLogP3: 2.6

Experimental Properties

  • Density: 1.47
  • Boiling Point: 415°Cat760mmHg
  • Flash Point: 204.8°C
  • Refractive Index: 1.634
  • PSA: 38.67
  • LogP: 1.96880

1,3,5-Triazine,2-chloro-4,6-bis(methylthio)- Related Literature

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