6-Methyl-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone | CAS No. 56-04-2

6-Methyl-2-thioxo-2,3-dihydro-4(1H)-pyrimidinone

Basic Information

CAS Number

56-04-2

Molecular Formula

C5H6N2OS

Molecular Weight

142.18 g/mol

AD

Basic Physical Properties

Melting Point

~330 °C (dec.)

Boiling Point

342.3°C at 760 mmHg

Flash Point

160.8 °C

Refractive Index

1.6430 (estimate)

CC1=CC(=O)NC(=S)N1

InChI

InChI=1S/C5H6N2OS/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9)

InChIKey

HWGBHCRJGXAGEU-UHFFFAOYSA-N

LogP

0.7793199999999998

Topological Polar Surface Area

46.010000000000005 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

197

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302
H351H351

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H351 Suspected of causing cancer
Carcinogenicity

Toxicity

MLD in rabbits (mg/kg): 2486 orally (Simon)

Synonyms & References

English

  • Muracin
  • CAS-56-04-2
  • 6-Methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine
  • Thiothyron
  • Tiotiron
  • Cc1cc(O)nc(S)n1
  • 6-Methyl-2-(methylthio)-4(3H)-pyrimidinone; 6-Methyl-2-(methylthio)-4-hydroxypyrimidine; 6-Methyl-2-(methylthio)-4-pyrimidone; NSC 193525; NSC 37678
  • CHEMBL1330588
  • Z56771013
  • 1123-10-0
  • 4-hydroxy-6-methylpyrimidine-2(1h)-thione
  • 2-Thio-4-oxo-6-methyl-1,3-pyrimidine
  • 56-04-2
  • Methiocil
  • Pharmakon1600-01500408
  • SPECTRUM1500408
  • Tiorale M
  • 6-Methyl-2-thio-2,3H)-pyrimidinedione
  • Prestwick_330
  • SCHEMBL11433163
  • 6-methyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
  • 2-Mercapto-6-methyl-4-pyrimidone
  • 6-Methyl-2-thio-2,4(1H,3H)-pyrimidinedione
  • Alkiron (VAN)
  • NCGC00259419-01
  • 6-methyl-2-sulfanylpyrimidin-4(3H)-one
  • 6-Methyl-2-mercaptouracil
  • IDI1_000719
  • 2-Mercapto-6-methylpyrimidin-4-ol
  • NCGC00091124-04
  • Methyl-6-thiouracil

MDL Number

MFCD00006040

Customs Code

29335995

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