Uridine Related Compound 1

Basic Information

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CAS Number

122567-97-9

Molecular Formula

C17H16N2O5

Molecular Weight

328.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC1=CN(C(=O)NC1=O)C2C=CC(O2)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H16N2O5/c1-11-9-19(17(22)18-15(11)20)14-8-7-13(24-14)10-23-16(21)12-5-3-2-4-6-12/h2-9,13-14H,10H2,1H3,(H,18,20,22)/t13-,14+/m0/s1

InChIKey

BKZQWZPYZIYYAQ-UONOGXRCSA-N

LogP

1.1556199999999996

Topological Polar Surface Area

90.39000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 7

Complexity

592

Safety Information

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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

SCHEMBL8405217
5'-Benzoyl-2',3'-dideoxy-2',3'-didehydrothymidine
Stavudine impurity I [EP IMPURITY]
[(2S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl benzoate
Thymidine, 2',3'-didehydro-3'-deoxy-, 5'-benzoate
C17H16N2O5
VKZ4492GHU
MFCD00871194
NS00120429
A804920
F19893
AKOS003621927
CS-0152875
122567-97-9
[(2S,5R)-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl benzoate
5'-benzoyl-D4T
2',3'-Didehydro-3'-deoxythymidine 5'-benzoate; 5'-O-Benzoyl-2',3'-didehydro-3'-deoxythymidine; Stavudine Imp. I (EP); Stavudine Impurity I
J-502684
BKZQWZPYZIYYAQ-UONOGXRCSA-N
DS-4433
((2S,5R)-5-(5-Methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2,5-dihydrofuran-2-yl)methyl benzoate
DTXSID20153648
[(2S,5R)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl benzoate
1-(5-O-Benzoyl-2,3-dideoxy-beta-D-glycero-pent-2-enofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione
2',3'-Didehydro-3'-deoxy-5'-benzoate thymidine
5'-BENZOYL-2',3'-DIDEHYDRO-3'-DEOXYTHYMIDINE (5'-BENZOYL-D4T)
Thymidine,2',3'-didehydro-3'-deoxy-, 5'-benzoate (9CI)
5'-O-benzoyl-2',3'-didehydro-3'-deoxythymidine
Stavudine impurity I
Thymidine,2',3'-didehydro-3'-deoxy-,5'-benzoate
5′-O-Benzoyl-2′,3′-didehydro-3′-deoxythymidine

MDL Number

MFCD00871194

FAQ

What regulatory guidelines apply to Uridine Related Compound 1 (CAS: 122567-97-9)?

Uridine Related Compound 1 (CAS: 122567-97-9) falls under the scope of the GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for hazardous substances. It must comply with REACH regulations in the European Union, which require registration and reporting of substances above one tonne per year. In the United States, it is regulated by the FDA for pharmaceutical applications and by the EPA for environmental and safety standards.

Are there alternatives to Uridine Related Compound 1 (CAS: 122567-97-9) in synthesis?

Alternatives to Uridine Related Compound 1 (CAS: 122567-97-9) in synthesis include related nucleosides and analogs such as thymidine or adenosine. Other common reagents used in synthesis include cytidine and other uridine derivatives. These alternatives can serve as effective substitutes based on specific reaction requirements and desired product properties.

What is the market or research trend for Uridine Related Compound 1 (CAS: 122567-97-9)?

The market for Uridine Related Compound 1 (CAS: 122567-97-9) is primarily driven by its applications in pharmaceuticals, particularly in the development of antiviral and anticancer drugs. Research trends focus on exploring its potential in gene therapy and RNA interference. The compound is also used in biological research for studying nucleotide metabolism and DNA synthesis. Market trends show increasing demand from academic and industrial research sectors.

How should waste containing Uridine Related Compound 1 (CAS: 122567-97-9) be handled?

Waste containing Uridine Related Compound 1 (CAS: 122567-97-9) should be collected in appropriate containers and stored safely to prevent environmental contamination. For small-scale waste, incineration is an effective method. For larger quantities, professional waste disposal services should be utilized. It is essential to follow local regulations and guidelines for the safe disposal of hazardous chemicals, including proper labeling and documentation of waste material. Environmental protection measures, such as Minimization and Recycling, should be prioritized to reduce the overall impact on the environment.