6-(Benzylsulfanyl)-9h-purin-9-amine
6-benzylsulfanylpurin-9-amine
Also Known As: 6-benzylsulfanylpurin-9-amine|6-(benzylsulfanyl)-9h-purin-9-amine|6-(Benzylthio)-9H-purin-9-amine|9-Amino-6-benzylthio-9H-purin|6-benzylsulfanyl-purin-9-ylamine
CAS: 21008-79-7
| Molecular Formula | C12H11N5S |
|---|---|
| Molecular Weight | 257.07352 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 94.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.07352 |
| Monoisotopic Mass | 257.07352 |
| Heavy Atoms | 18 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 21008-79-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC=NC3=C2N=CN3N |
| InChIKey | CWYHLPSFDNKSAL-UHFFFAOYSA-N |
Product Overview
6-(Benzylsulfanyl)-9h-purin-9-amine (CAS 21008-79-7), with molecular formula C12H11N5S and molecular weight 257.07352 g/mol. IUPAC: 6-benzylsulfanylpurin-9-amine.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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