2'-Cytidylic acid

Basic Information

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CAS Number

85-94-9

Molecular Formula

C9H14N3O8P

Molecular Weight

323.2 g/mol

EINECS

201-643-1

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Insecticides

Basic Physical Properties

Melting Point

240-242 °C (decomp)

Boiling Point

693.7±65.0 °C(Predicted)

Density

2.15±0.1 g/cm3(Predicted)

SMILES

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c1cn(c(=O)nc1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)OP(=O)(O)O

InChI

InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(20-21(16,17)18)6(14)4(3-13)19-8/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1

InChIKey

YQUAKORMLHPSLZ-XVFCMESISA-N

LogP

-2.446

pKa

pK1:0.8(+1);pK2:4.36(0);pK3:6.17(+1) (25°C)

Topological Polar Surface Area

177.35999999999999 Å²

Hydrogen Bond Donor/Acceptor

6 / 11

Synonyms & References

English

CYTIDINE 2'-MONOPHOSPHATE
2-cytidylic acid
cytidine 2-(dihydrogen phosphate)
cytidine 2'-monophosphate free acid
2'-Cytidilic acid
2'-Cytidine phosphoric acid
2'-Cytosylic acid
Cytidine 2'-monophosphate 2‘-CMP
2'-Cytidylic acid
CYTIDINE 2'-MONOPHOS
Cytidine 2'-phosphoric acid
cytidine-2'-monophosphate
Cytidine-2'-Monophosphoric Acid
Cytosylic acid a
Cytidine 2’-phosphate

EC Number

201-643-1

FAQ

What are the physical and chemical properties of 2'-Cytidylic acid (CAS: 85-94-9)?

2'-Cytidylic acid is a white crystalline solid with a molecular weight of approximately 346.21 g/mol. It is slightly soluble in water and ethanol. Chemically, it is reactive towards base catalyzed hydrolysis and is stable under acidic conditions. It has a pKa of approximately 7.0.

How is 2'-Cytidylic acid (CAS: 85-94-9) typically synthesized?

2'-Cytidylic acid is commonly synthesized through the condensation of cytosine and ATP in the presence of a base catalyst such as sodium carbonate. The reaction is typically performed in aqueous media at neutral pH. Yields are usually around 70-80%, and the product can be purified by column chromatography or recrystallization.

What industries use 2'-Cytidylic acid (CAS: 85-94-9)?

2'-Cytidylic acid is primarily used in the pharmaceutical industry for the synthesis of nucleoside analogs and antiviral drugs. It also finds applications in the polymer industry for the development of biodegradable polymers and in the semiconductor industry as a dopant in organic thin-film transistors.

What precautions should be taken when handling 2'-Cytidylic acid (CAS: 85-94-9)?

When handling 2'-Cytidylic acid, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a fume hood due to its potential to generate reactive metabolites. Spills should be cleaned up with caution, using absorbent materials and disposing of the waste according to local regulations. Refer to the Safety Data Sheet (SDS) for detailed information on handling and storage.