Cas no 6217-61-4 (2,4(1H,3H)-Pyrimidinedithione,5-methyl-)

2,4(1H,3H)-Pyrimidinedithione,5-methyl- structure
6217-61-4 structure
Product Name:2,4(1H,3H)-Pyrimidinedithione,5-methyl-
CAS No:6217-61-4
MF:C5H6N2S2
MW:158.244537830353
MDL:MFCD00056034
CID:503368
PubChem ID:3034173
Update Time:2025-04-19

2,4(1H,3H)-Pyrimidinedithione,5-methyl- Chemical and Physical Properties

Names and Identifiers

    • 2,4(1H,3H)-Pyrimidinedithione,5-methyl-
    • (5-methyl)dithiouracil
    • 5-methyl-1H-pyrimidine-2,4-dithione
    • 2,4-Dimercapto-5-methylpyrimidine
    • 2,4-Dithio-thymin
    • 2,4-Dithioxa-thymin
    • 5-Methyl-1H-pyrimidin-2,4-dithion
    • 5-Methyl-2,4(1H,3H)-pyrimidinedithione
    • 5-Methyl-thiouracil
    • AI3-52684
    • Dithiothymine
    • EINECS 228-286-4
    • Thymine, dithio-
    • NS00034950
    • 5-methyl-2,4-dithiopyrimidine
    • NSC 32655
    • KQRLVMSUOWYRHL-UHFFFAOYSA-N
    • DTXSID50211225
    • 5-Methyl-2,3H)-pyrimidinedithione
    • NSC32655
    • 5-Methyl-2,4-pyrimidinedithiol
    • 5-Methylpyrimidine-2,4-dithiol
    • SB56144
    • 6217-61-4
    • SCHEMBL159649
    • WLN: T6MYMYJ BUS DUS E1
    • 2,3H)-Pyrimidinedithione, 5-methyl-
    • W17242
    • 5-METHYL-1,3-DIHYDROPYRIMIDINE-2,4-DITHIONE
    • BS-53301
    • 2,4(1H,3H)-Pyrimidinedithione, 5-methyl-
    • NSC-32655
    • 5-methylpyrimidine-2,4(1H,3H)-dithione
    • Dithiothymin
    • AKOS024337986
    • MDL: MFCD00056034
    • Inchi: 1S/C5H6N2S2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)
    • InChI Key: KQRLVMSUOWYRHL-UHFFFAOYSA-N
    • SMILES: S=C1C(C)=CNC(N1)=S

Computed Properties

  • Exact Mass: 157.99738
  • Monoisotopic Mass: 157.997
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 195
  • 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: 0.6
  • Topological Polar Surface Area: 88.2?2

Experimental Properties

  • Density: 1.41
  • Boiling Point: 236°C at 760 mmHg
  • Flash Point: 96.5°C
  • Refractive Index: 1.722
  • PSA: 24.06
  • LogP: 2.11020

2,4(1H,3H)-Pyrimidinedithione,5-methyl- Pricemore >>

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