4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione | CAS No. 13239-97-9

4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione

Basic Information

CAS Number

13239-97-9

Molecular Formula

C9H13N3O4S

Molecular Weight

259.29 g/mol

AD

Basic Physical Properties

C1=CN(C(=S)N=C1N)C2C(C(C(O2)CO)O)O

InChI

InChI=1S/C9H13N3O4S/c10-5-1-2-12(9(17)11-5)8-7(15)6(14)4(3-13)16-8/h1-2,4,6-8,13-15H,3H2,(H2,10,11,17)

InChIKey

RHFUOMFWUGWKKO-UHFFFAOYSA-N

LogP

-1.1937100000000003

Topological Polar Surface Area

113.76 Ų

Hydrogen Bond Donor/Acceptor

5 / 7

Complexity

386

Synonyms & References

English

  • BS-52259
  • Q20890505
  • BRD-K67390410-001-01-2
  • NS00024211
  • DTXSID30157516
  • Cytidine, 2-thio-
  • SCHEMBL42103
  • 4-amino-1-beta-D-ribofuranosylpyrimidine-2(1H)-thione
  • 2(1H)-Pyrimidinethione, 4-amino-1-.beta.-D-ribofuranosyl-
  • 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2-thione
  • 4-Amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2(1H)-thione
  • 13239-97-9
  • E77917
  • EINECS 236-214-8
  • AKOS030573862
  • 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2-thione
  • beta-D-ribofuranosyl-2-thiocytidine
  • CHEBI:19780
  • 2-Thiocytidine
  • PD150569
  • 2-Thiocytidin
  • Cytidine,2-thio
  • 2-THIOCYTIDINE DIHYDRATE
  • 1-(β-D-Ribofuranosyl)-4-aminopyrimidine-2(1H)-thione
  • 2-THIOCYTIDINE DIHYDRATE CRYSTALLINE 98%

MDL Number

MFCD00006557

FAQ

What are the physical and chemical properties of 4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9)?

4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9) is a crystalline solid with a molecular weight of approximately 281.14 g/mol. It is slightly soluble in water and has a low reactivity under normal conditions. This compound has a low melting point and is stable under typical laboratory conditions.

How is 4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9) typically synthesized?

4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9) can be synthesized through a multistep process involving the coupling of 1-pentofuranosyl-2(1H)-pyrimidinone and an amino group. Common catalysts include phosphorus reagents, and the yield is typically around 70-80%.

What industries use 4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9)?

4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9) is primarily used in the pharmaceutical industry for the development of novel drugs. It also has applications in the polymer industry for developing advanced materials and in the sensor industry for use in chemical sensing applications.

What precautions should be taken when handling 4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9)?

When handling 4-Amino-1-pentofuranosyl-2(1H)-pyrimidinethione (CAS: 13239-97-9), it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or under a fume hood. In the event of a spill, immediately clean up the area and consult the Safety Data Sheet (SDS) for further guidance.

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