2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid | CAS No. 397308-78-0

2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid

Basic Information

CAS Number

397308-78-0

Molecular Formula

C6H6N2O3S

Molecular Weight

186.19 g/mol

AD

Basic Physical Properties

CSC1=NC=C(C(=O)N1)C(=O)O

InChI

InChI=1S/C6H6N2O3S/c1-12-6-7-2-3(5(10)11)4(9)8-6/h2H,1H3,(H,10,11)(H,7,8,9)

InChIKey

MOAJQWKFKCJUKP-UHFFFAOYSA-N

LogP

0.6022999999999998

Topological Polar Surface Area

83.31 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

295

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • 2-(methylthio)-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid
  • 2-Methylsulfanyl-6-oxo-1,6-dihydro-pyrimidin e-5-carboxylic acid
  • J-515468
  • AKOS005138146
  • 4-Hydroxy-2-methylmercaptopyrimidine-5-carboxylic acid
  • A873581
  • DS-0608
  • CHEMBL5089117
  • SB56066
  • 4-hydroxy-2-(methylsulfanyl)pyrimidine-5-carboxylic acid
  • BB 0240271
  • 4-Hydroxy-2-methylsulfanylpyrimidine-5-carboxylic acid
  • SCHEMBL46639
  • 4-Hydroxy-2-(methylthio)pyrimidine-5-carboxylic acid, AldrichCPR
  • NSC-165520
  • SY105353
  • BDBM50580318
  • MFCD09759031
  • NSC165520
  • CS-0045760
  • MOAJQWKFKCJUKP-UHFFFAOYSA-N
  • FT-0646179
  • 4-HYDROXY-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID
  • DTXSID50304363
  • 2-methylsulfanyl-6-oxo-1H-pyrimidine-5-carboxylic acid
  • 3,4-Dihydro-2-methylthio-4-oxopyrimidine-5-carboxylic acid
  • EN300-143590
  • 5-Pyrimidinecarboxylicacid,1,6-dihydro-2-(methylthio)-6-oxo-
  • 397308-78-0
  • 4-Hydroxy-2-methylsulfanyl-pyrimidine-5-carboxylic acid
  • AKOS015919862

MDL Number

MFCD09759031

Customs Code

2933599090

FAQ

What is 2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid (CAS: 397308-78-0)?

2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid is a compound with the CAS number 397308-78-0. It is an organic compound with a pyrimidine ring structure, characterized by its methylsulfanyl substituent and carboxylic acid group. It is usually a white solid, soluble in water and ethanol.

What are the main uses of 2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid (CAS: 397308-78-0)?

2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid is primarily used in pharmaceuticals, serving as a precursor for the synthesis of various drugs. It is also utilized in research for its potential as a bioactive compound and in the development of novel materials.

Is 2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid (CAS: 397308-78-0) safe?

2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid is generally considered safe when handled properly. However, it is important to follow safety guidelines, such as avoiding contact with skin and eyes, and ensuring adequate ventilation during handling. Use appropriate personal protective equipment (PPE) like gloves and goggles.

How should 2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid (CAS: 397308-78-0) be stored?

2-(Methylsulfanyl)-4-oxo-1,4-dihydro-5-pyrimidinecarboxylic acid should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a sealed container to prevent moisture absorption. Store it at room temperature and avoid exposure to temperatures exceeding 30°C.

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