Cas no 1193-28-8 (2,4-Dimercapto pyrimidine)

2,4-Dimercapto pyrimidine structure
2,4-Dimercapto pyrimidine structure
Product Name:2,4-Dimercapto pyrimidine
CAS No:1193-28-8
MF:C4H4N2S2
MW:144.217957496643
CID:2195139
PubChem ID:1712448
Update Time:2025-04-21

2,4-Dimercapto pyrimidine Chemical and Physical Properties

Names and Identifiers

    • 2,4-Dimercapto pyrimidine
    • NSC42031
    • 2,4(1H,3H)-Pyrimidinedithione
    • InChI=1/C4H4N2S2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8
    • Dithiopyrimidine
    • 2,4-Dithioxopyrimidine
    • D87918
    • 1193-28-8
    • 2(1H)-Pyrimidinethione, 4-mercapto- (9CI)
    • 133039-83-5
    • 2,4-Dithiopyrimidine
    • URACIL, 2,4-DITHIO-
    • 2.4-Dithiopyrimidine
    • 4-sulfanyl-2(3H)-pyrimidinethione
    • DB-272196
    • Pyrimidine-2,4-dithiol
    • 2,4-Dithiouracil
    • 2(1H)-PYRIMIDINETHIONE, 4-MERCAPTO-
    • 2(1H)-PYRIMIDINETHIONE, 6-MERCAPTO-
    • EINECS 217-894-5
    • 2(1H)-Pyrimidinethione, 6-mercapto- (9CI)
    • 107686-58-8
    • NSC 42031
    • AKOS006223236
    • pyrimidine-2,4(1H,3H)-dithione
    • 1H-pyrimidine-2,4-dithione
    • 2,4-Pyrimidinedithiol (9CI)
    • DTXSID80173827
    • 2001-93-6
    • DB-272031
    • AS-59788
    • 2,3H)-Pyrimidinedithione
    • SB55549
    • NSC-42031
    • STK361597
    • 2,4-dithio-uraci
    • MFCD00006042
    • 2,4-Pyrimidinedithiol
    • Dithiouracil
    • FD40884
    • 133099-49-7
    • NCGC00338889-01
    • 4(3H)-PYRIMIDINETHIONE, 2-MERCAPTO-
    • DB-346487
    • 4(3H)-Pyrimidinethione, 2-mercapto- (9CI)
    • AKOS000526100
    • DB-268877
    • AB-323/25048186
    • Uracil,4-dithio-
    • SCHEMBL14483825
    • 4(1H)-PYRIMIDINETHIONE, 2-MERCAPTO-
    • NS00026498
    • SCHEMBL25841595
    • 132939-84-5
    • SCHEMBL160984
    • AB01331643-02
    • 1,2,3,4-tetrahydropyrimidine-2,4-dithione
    • CHEMBL3934582
    • 4(3H)-Pyrimidinethione,2-mercapto-(9ci)
    • AI3-25475
    • Z2311575088
    • 2,4-Dimercaptopyrimidine
    • 132939-82-3
    • WLN: T6MYMYJ BUS DUS
    • Dithiouracil, 98%
    • DB-268886
    • USAF CB-14
    • 4(1H)-Pyrimidinethione, 2-mercapto- (9CI)
    • Inchi: 1S/C4H4N2S2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)
    • InChI Key: ZEQIWKHCJWRNTH-UHFFFAOYSA-N
    • SMILES: S=C1NC=CC(N1)=S

Computed Properties

  • Exact Mass: 143.98159048Da
  • Monoisotopic Mass: 143.98159048Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 161
  • 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: 0.3
  • Topological Polar Surface Area: 88.2?2
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