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Home/Compounds/CAS 2022-85-7
Formula C4H4FN3OMW 129.09Research-use catalog entryCOA/SDS by request

Flucytosine

CAS Number: 2022-85-7

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Loading RDKit molecule structure...
InChIKey: XRECTZIEBJDKEO-UHFFFAOYSA-NC4H4FN3O | MW 129.09

Chemical Absolute Identifiers

CAS Number

2022-85-7

PubChem CID

3366

Molecular Formula

C4H4FN3O

Molecular Weight

129.09 g/mol

Exact Mass

129.03384

InChIKey

XRECTZIEBJDKEO-UHFFFAOYSA-N

IUPAC Name

6-amino-5-fluoro-1H-pyrimidin-2-one

SMILES String

C1=NC(=O)NC(=C1F)N

Physical Properties

Melting Point

295–297 °C

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

Flucytosine (CAS 2022-85-7) is listed in the Pharmaceutical Intermediates portfolio, with molecular formula C4H4FN3O and molecular weight 129. 09 g/mol.

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Intended for research-stage medicinal chemistry and intermediate synthesis workflows; structure-derived tags include nitrogen-containing heterocycle.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Pharmaceutical Intermediate ResearchResearch intermediateCustom synthesis building blockPharmaceutical intermediate researchResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Alpha-1A adrenergic receptor (Homo sapiens) — 3 assays; Cannabinoid receptor 1 (Homo sapiens) — 3 assays; 5-hydroxytryptamine receptor 1A (Homo sapiens) — 2 assays; 5-hydroxytryptamine receptor 2A (Homo sapiens) — 2 assays; 5-hydroxytryptamine receptor 2B (Homo sapiens) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Alpha-1A adrenergic receptor

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Cannabinoid receptor 1

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

5-hydroxytryptamine receptor 1A

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

5-hydroxytryptamine receptor 2A

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

5-hydroxytryptamine receptor 2B

Homo sapiens · SINGLE PROTEIN · 2 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Safety & Handling

Handling & Storage

  • Keep container tightly closed and dry.
  • Store in a well-ventilated place.

PPE

Respiratory protection if needed

First Aid

  • Do not give anything to an unconscious person.
  • Rinse mouth with water.

Stability / Reactivity

  • Reactivity.
  • Carbon monoxide, carbon dioxide, hydrogen fluoride, nitrogen oxides.

Disposal

  • Dispose of remaining and non-recyclable solutions to a licensed company.
  • Contact a professional agency with a waste disposal license to handle this substance.
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Fire Fighting

  • If necessary, wear a self-contained breathing apparatus for firefighting.

Accidental Release

  • Do not generate dust when collecting and disposing.
  • Sweep and shovel up.

For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.

Preliminary Safety Reference

For supplier-issued SDS or COA, submit a documentation request.

Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

Flucytosine

Names & Synonyms

5-FluorocytosineFluorocytosineAncobonAncotilFluocytosine
Show all synonyms
5-FluorocystosineFlucytosin5-FluorocytosinFluorcytosineAlcobonFlucytosinum4-Amino-5-fluoropyrimidin-2(1H)-oneRo 2-9915FlucitosinaCytosine, 5-fluoro-5-Flucytosine4-Amino-5-fluoro-2(1H)-pyrimidinone2(1H)-Pyrimidinone, 4-amino-5-fluoro-2-Hydroxy-4-amino-5-fluoropyrimidine
External Identifiers
EC NUMBER: 217-968-7DSSTOX SUBSTANCE ID: DTXSID3023059CHEMBL ID: CHEMBL1463CHEBI ID: CHEBI:5100UNII: D83282DT06DRUGBANK ID: DB01099HMDB ID: HMDB0015231KEGG ID: D00323METABOLOMICS WORKBENCH ID: 43329NCI THESAURUS CODE: C501PHARMGKB ID: PA449654RXCUI: 4451WIKIDATA ID: Q238490
Experimental Spectrum References
13C NMR Spectra19F NMR Spectra1H NMR SpectraATR-IR Spectra — Forensic Spectral ResearchFTIR SpectraRaman Spectra — Forensic Spectral Research
Literature & Patent References
DOI 10.1021/acs.jmedchem.5c00396On-Resin Assembly of Macrocyclic Inhibitors of <i>Cryptococcus neoformans</i> May1: A Pathway to Potent Antifungal Agents.DOI 10.1021/acs.jnatprod.4c00834Cyclic Peptide Natural Product Inspired Inhibitors of the Free-Living Amoeba <i>Balamuthia mandrillaris</i>.PMID 39948695Cyclic Peptide Natural Product Inspired Inhibitors of the Free-Living Amoeba <i>Balamuthia mandrillaris</i>.PMID 40262033On-Resin Assembly of Macrocyclic Inhibitors of <i>Cryptococcus neoformans</i> May1: A Pathway to Potent Antifungal Agents.DOI 10.1016/j.bmcl.2024.129931Inhibitors of Rickettsia prowazekii methionine aminopeptidase 1 identified from the Pandemic Response Box.DOI 10.1016/j.isci.2024.108907Identification and evaluation of small-molecule inhibitors against the dNTPase SAMHD1 via a comprehensive screening funnelPMID 38318365Identification and evaluation of small-molecule inhibitors against the dNTPase SAMHD1 via a comprehensive screening funnelPMID 39154713Inhibitors of Rickettsia prowazekii methionine aminopeptidase 1 identified from the Pandemic Response Box.

Documentation & Compliance Facts

Compliance Facts

Shipment review: Required

Documentation available by request

Certificate of Analysis (COA): By request

Supplier Safety Data Sheet (SDS): By request

Purity and pack size confirmation: By request

Availability and lead time review: Confirmed by RFQ

Shipment documentation review: By request

For supplier-issued documentation by request, use the RFQ actions on this page.Review preliminary safety reference

What happens after RFQ

  1. 1We review the CAS identity, quantity, and documentation request.
  2. 2We check sourcing options, supplier availability, COA/SDS, purity, pack size, and lead time.
  3. 3We review destination and shipment documentation needs when applicable.
  4. 4We follow up with a quotation or clarification request.

Text Reference Cues

Additional text reference cues are not available for this catalog entry.

Non-public references are shown as text only and do not imply equivalence, availability, or shared use.

Catalog navigation

Related Catalog Entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

CAS 71-30-7CytosineCAS 100643-71-8DesloratadineCAS 181695-72-7ValdecoxibCAS 22204-53-1NaproxenCAS 102767-28-2LevetiracetamCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamateCAS 1005174-17-3(E)-3-(2-Propyl-6-(trifluoromethyl)pyridin-3-yl)acrylic acidCAS 1018125-49-92-(3-Cyclopropyl-6-ethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acidCAS 1018128-07-8Isopropyl 4-chloro-2-methylquinoline-6-carboxylateCAS 1018142-22-76-cyclopropyl-1-(2,2-difluoroethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

RFQ questions for CAS 2022-85-7

What are the key identifiers for Flucytosine (CAS 2022-85-7)?

Flucytosine is identified by CAS 2022-85-7, with molecular formula C4H4FN3O, molecular weight 129.09, InChIKey XRECTZIEBJDKEO-UHFFFAOYSA-N.

Does CAS 2022-85-7 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Alpha-1A adrenergic receptor, Cannabinoid receptor 1, 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 2A, 5-hydroxytryptamine receptor 2B. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 2022-85-7?

Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.

Can I request supplier SDS for Flucytosine?

Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.

Is CAS 2022-85-7 available for quotation?

Availability, pack size, lead time, and pricing are confirmed through RFQ.

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