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Home/Compounds/CAS 4291-63-8
Formula C10H12ClN5O3MW 285.69Research-use catalog entryCOA/SDS by request

Cladribine

CAS Number: 4291-63-8

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Loading RDKit molecule structure...
InChIKey: PTOAARAWEBMLNO-KVQBGUIXSA-NC10H12ClN5O3 | MW 285.69

Chemical Absolute Identifiers

CAS Number

4291-63-8

PubChem CID

20279

Molecular Formula

C10H12ClN5O3

Molecular Weight

285.69 g/mol

Exact Mass

285.062867

InChIKey

PTOAARAWEBMLNO-KVQBGUIXSA-N

IUPAC Name

(2R,3S,5R)-5-(6-amino-2-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

SMILES String

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=C(N=C32)Cl)N)CO)O

Physical Properties

Appearance

Crystals from water, softens at 210-215 °C, solidifies and turns brown ... Also reported as crystals from ethanol

Melting Point

215.0 °C

Water Solubility

6.35 g/L

pKa

1.21

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

Catalog Facts

Structural features

Cladribine (CAS 4291-63-8) is listed in the Advanced Chemicals portfolio, with molecular formula C10H12ClN5O3 and molecular weight 285. 69 g/mol.

Sourcing context

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

Research use context

Intended for research building-block and synthetic chemistry 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

Heterocyclic Building BlocksSynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Cellular tumor antigen p53 (Homo sapiens) — 3 assays; Deoxycytidine kinase (Homo sapiens) — 4 assays; Nuclear factor erythroid 2-related factor 2 (Homo sapiens) — 3 assays; Nuclear receptor subfamily 1 group I member 2 (Homo sapiens) — 3 assays; 5-hydroxytryptamine receptor 1A (Homo sapiens) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Cellular tumor antigen p53

Homo sapiens · SINGLE PROTEIN · 3 qualifying assays · 1 documents · best pChEMBL 4.9

Experimental evidence source: ChEMBL

Deoxycytidine kinase

Homo sapiens · SINGLE PROTEIN · 4 qualifying assays · 1 documents

Experimental evidence source: ChEMBL

Nuclear factor erythroid 2-related factor 2

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

Experimental evidence source: ChEMBL

Nuclear receptor subfamily 1 group I member 2

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

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 chloride, nitrogen oxides.

Disposal

  • Waste product: 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

Cladribine

Names & Synonyms

2-Chloro-2'-deoxyadenosineLeustatin2-Chlorodeoxyadenosine2-CdAChlorodeoxyadenosine
Show all synonyms
LitakADENOSINE, 2-CHLORO-2'-DEOXY-CldAdo2-Chloro-2'-deoxy-beta-adenosinecladribinamavencladCladaribinecladribinumLeustat2-chloro-deoxyadenosineRWJ 262512ClAdo2-chloro-6-amino-9-(2-deoxy-beta-D-erythro-pentofuranosyl)purine2-Chloro-6-amino-9-(2-deoxy-beta-D-erythropentofuranosyl)purine
External Identifiers
EC NUMBER: 636-978-6DSSTOX SUBSTANCE ID: DTXSID8022828CHEMBL ID: CHEMBL1619CHEBI ID: CHEBI:567361UNII: 47M74X9YT5DRUGBANK ID: DB00242HMDB ID: HMDB0014387KEGG ID: D01370METABOLOMICS WORKBENCH ID: 42644NCI THESAURUS CODE: C1336PHARMGKB ID: PA449027RXCUI: 44157WIKIDATA ID: Q414030
Experimental Spectrum References
13C NMR Spectra15N NMR Spectra
Literature & Patent References
DOI 10.1016/j.bmcl.2024.129775Synthesis and cytotoxicity of novel 6,8,9-trisubstituted purine analogs against liver cancer cells.DOI 10.1016/j.ejmech.2024.116437Perspectives and challenges in developing small molecules targeting purine nucleoside phosphorylase.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 38688437Synthesis and cytotoxicity of novel 6,8,9-trisubstituted purine analogs against liver cancer cells.PMID 38701712Perspectives and challenges in developing small molecules targeting purine nucleoside phosphorylase.DOI 10.1016/j.ejmech.2023.115244Design, synthesis and biological evaluation of Nucleosidic CD99 inhibitors that selectively reduce Ewing sarcoma viability.DOI 10.1038/s41467-023-40064-9A preclinical secondary pharmacology resource illuminates target-adverse drug reaction associations of marketed drugs.

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

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Non-public related references

2-IodoadenosineCAS 35109-88-7
2-FluoroadenosineCAS 146-78-1
DideoxyadenosineCAS 4097-22-7
9H-Purin-6-amine, 2-chloro-9-methyl-CAS 7013-21-0
Fludarabine PhosphateCAS 75607-67-9

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 35109-88-72-IodoadenosineCAS 146-78-12-FluoroadenosineCAS 4097-22-7DideoxyadenosineCAS 7013-21-09H-Purin-6-amine, 2-chloro-9-methyl-CAS 21829-25-4NifedipineCAS 23593-75-1ClotrimazoleCAS 443913-73-3VandetanibCAS 21679-14-1FludarabineCAS 100643-71-8DesloratadineCAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamate

RFQ questions for CAS 4291-63-8

What are the key identifiers for Cladribine (CAS 4291-63-8)?

Cladribine is identified by CAS 4291-63-8, with molecular formula C10H12ClN5O3, molecular weight 285.69, InChIKey PTOAARAWEBMLNO-KVQBGUIXSA-N.

Does CAS 4291-63-8 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Cellular tumor antigen p53, Deoxycytidine kinase, Nuclear factor erythroid 2-related factor 2, Nuclear receptor subfamily 1 group I member 2, 5-hydroxytryptamine receptor 1A. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 4291-63-8?

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

Can I request supplier SDS for Cladribine?

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

Is CAS 4291-63-8 available for quotation?

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

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