2-Chloro-3'-Deoxyadenosine

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Properties Simple | Detailed

Formula C10H12ClN5O3
IUPAC Name (2r,3r,5s)-2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3-ol
Molecular Mass 285.687 g·mol−1
Heat of Formation -323.1 ± 16.7 kJ·mol−1
Dipole Moment 1.76 ± 1.08 D
Volume 299.78 Å 3
Surface Area 269.07 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,5s)-2-(6-amino-2-chloro-9-purinyl)-5-(hydroxymethyl)-3-tetrahydrofuranol
  • (2r,3r,5s)-2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)oxolan-3-ol
  • (2r,3r,5s)-2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3-ol
  • (2r,3r,5s)-2-(6-amino-2-chloro-purin-9-yl)-5-methylol-tetrahydrofuran-3-ol
  • 3'-deoxy-2-chloroadenosine
  • adenosine, 2-chloro-3'-deoxy-
CAS Number(s)
  • 115044-75-2
InChIKey HNSLUZJFGNTTEV-OBXARNEKSA-N
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Elements H C N O Cl