4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone

Basic Information

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CAS Number

56632-83-8

Molecular Formula

C9H12FN3O4

Molecular Weight

245.21 g/mol

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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

500.1°C at 760 mmHg

SMILES

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

InChI

InChI=1S/C9H12FN3O4/c10-6-7(15)4(3-14)17-8(6)13-2-1-5(11)12-9(13)16/h1-2,4,6-8,14-15H,3H2,(H2,11,12,16)/t4-,6+,7-,8-/m1/s1

InChIKey

NVZFZMCNALTPBY-PXBUCIJWSA-N

LogP

-1.5858000000000003

Topological Polar Surface Area

110.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

4 / 7

Complexity

386

Safety Information

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Hazard Statement

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'deoxy-2'-fluoroarabinocytidine
AS-47420
56632-83-8
4-amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;4-amino-1-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
UNII-688292GL11
4-Amino-1-(2-deoxy-2-fluoro-D-arabinofuranosyl)-2(1H)-pyrimidinone
4-amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
AKOS022175562
4-Amino-1-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one hydrochloride;4-Amino-1-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
4-Amino-1-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
AC-32316
688292GL11
1-(2'-Deoxy-2'-fluoro-b-D-arabinofuranosyl)cytidine hydrochloride
2'-Fluoro-2'-deoxy-arabinofuranosyl-cytidine
Q27264239
A848775
4-AMINO-1-((2R,3S,4R,5R)-3-FLUORO-4-HYDROXY-5-(HYDROXYMETHYL)OXOLAN-2-YL)PYRIMIDIN-2-ONE
4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone
4-amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
CHEMBL484963
2(1H)-Pyrimidinone, 4-amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-
DTXSID30205208
MFCD07374399
SCHEMBL170263
F13669
2??-Deoxy-2??-fluoro-beta-D-arabinocytidine
4-Amino-1-((2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidin-2-one
4-Amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
1-(2'-DEOXY-2'-FLUORO-B-D-ARABINOFURANOSYL)CYTOSINE
2(1H)-Pyrimidinone, 4-amino-1-(2-deoxy-2-fluoro-β-D-arabinofuranosyl)-
4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-pyrimidine-2(1H)-one

MDL Number

MFCD07374399

FAQ

What regulatory guidelines apply to 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8)?

4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8) is subject to various regulatory guidelines. Under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), it falls under category 2 for skin corrosion/irritation. It is also regulated under the European Union's REACH regulations and requires notification to the US FDA and EPA if used in pharmaceutical or agricultural products. Proper labeling, storage, and disposal practices are essential to comply with these regulations.

Are there alternatives to 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8) in synthesis?

There are several alternatives to 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8) in synthesis, including similar derivatives such as 2-deoxy-2-fluoro-beta-D-arabinofuranosyl derivatives and related pyrimidine analogs. Common alternative reagents include fluoroarabinosylated compounds and other nucleoside analogs. These alternatives offer similar properties and can be used as substitutes depending on specific synthetic needs.

What is the market or research trend for 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8)?

The market for 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8) is primarily driven by its potential applications in antiviral and anticancer research. Recent trends show a growing interest in this compound for its ability to inhibit viral replication and its potential as a therapeutic agent. Research continues to explore its effectiveness in various disease models and its potential for further drug development.

How should waste containing 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8) be handled?

Waste containing 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone (CAS: 56632-83-8) should be handled according to local environmental regulations. Collection should be done in appropriate containers and stored separately to prevent contamination. For disposal, it is recommended to use professional waste disposal services that comply with hazardous waste management standards. Proper incineration or chemical treatment may be necessary to ensure environmental safety during disposal.