Abacavir

CAS Registry Number®

136470-78-5

CAS Name

Abacavir

Molecular Formula

C14H18N6O

Molecular Mass

286.33

Cite this Page

Abacavir.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=136470-78-5 (retrieved 2024-11-24) (CAS RN: 136470-78-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    125-128 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C14H18N6O/c15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21/h1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19)/t8-,10+/m1/s1

InChIKey

InChIKey=MCGSCOLBFJQGHM-SCZZXKLOSA-N

SMILES

N(C1=C2C(N(C=N2)[C@@H]3C[C@H](CO)C=C3)=NC(N)=N1)C4CC4

Canonical SMILES

OCC1C=CC(N2C=NC=3C(=NC(=NC32)N)NC4CC4)C1

Other Names for this Substance

  • 2-Cyclopentene-1-methanol, 4-[2-amino-6-(cyclopropylamino)-9H-purin-9-yl]-, (1S,4R)-
  • 2-Cyclopentene-1-methanol, 4-[2-amino-6-(cyclopropylamino)-9H-purin-9-yl]-, (1S-cis)-
  • (1S,4R)-4-[2-Amino-6-(cyclopropylamino)-9H-purin-9-yl]-2-cyclopentene-1-methanol
  • Abacavir
  • 1592U89

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