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Cladribine

CAS Registry Number®

4291-63-8

CAS Name

Cladribine

Molecular Formula

C10H12ClN5O3

Molecular Mass

285.69

Cite this Page

Cladribine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4291-63-8 (retrieved 2024-11-23) (CAS RN: 4291-63-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    208-210 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H12ClN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)/t4-,5+,6+/m0/s1

InChIKey

InChIKey=PTOAARAWEBMLNO-KVQBGUIXSA-N

SMILES

NC1=C2C(N(C=N2)[C@@H]3O[C@H](CO)[C@@H](O)C3)=NC(Cl)=N1

Canonical SMILES

ClC=1N=C(N)C=2N=CN(C2N1)C3OC(CO)C(O)C3

Other Names for this Substance

  • Adenosine, 2-chloro-2′-deoxy-
  • 2-Chloro-2′-deoxyadenosine
  • 2-Chloro-2′-deoxy-β-adenosine
  • 2-Chloro-6-amino-9-(2-deoxy-β-D-erythro-pentofuranosyl)purine
  • 2-Chlorodeoxyadenosine

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Deleted or Replaced CAS Registry Numbers

24757-90-2, 2415265-73-3

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