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CAS Number: 442685-41-8
tert-butyl 2-amino-6-chloro-9H-purine-9-carboxylate

Structure

 tert-butyl 2-amino-6-chloro-9H-purine-9-carboxylate
Name: tert-butyl 2-amino-6-chloro-9H-purine-9-carboxylate
Synonyms:
General Information
Product Number: 442685418

CAS Registry Number 442685-41-8
Name:
9H-?Purine-?9-?carboxylic acid, 2-?amino-?6-?chloro-?, 1,?1-?dimethylethyl ester
N9-Boc-2-amino-6-chloropurine

 

Chemical Formula: C10H12ClN5O2
Exact Mass: 269.07
Molecular Weight: 269.69
m/z: 269.07 (100.0%), 271.07 (33.1%), 270.07 (11.0%), 272.07 (3.5%), 270.06 (1.8%)

 

InChI:InChI=1S/C10H12ClN5O2/c1-10(2,3)18-9(17)16-4-13-5-6(11)14-8(12)15-7(5)16/h4H,1-3H3,(H2,12,14,15)

InChI Key:WEIGRPOHGWVOBI-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1C=NC2=C1N=C(N=C2Cl)N

Specification

98%
References
  1. (1) Shahani, Vijay M.; ACS Medicinal Chemistry Letters 2011, V2(1), P79-84 CAPLUS
  2. (2) Fletcher, Steven; Tetrahedron Letters 2009, V50(29), P4258-4261 CAPLUS
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