7-butyl-3H-purine-6-thione structure

7-butyl-3H-purine-6-thione

7-butyl-3H-purine-6-thione

Also Known As: 7-butyl-3H-purine-6-thione|7-Butyl-3,7-dihydro-6H-purine-6-thione

CAS: 7495-68-3
Molecular Formula C9H12N4S
Molecular Weight 208.07826 g/mol
LogP 2.28899
Topological Polar Surface Area 46.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 208.07826
Monoisotopic Mass 208.07826
Heavy Atoms 14
Complexity 484.76276

Chemical Identifiers

CAS Number 7495-68-3
SMILES CCCCN1C=NC2=C1C(=S)N=CN2

Product Overview

7-butyl-3H-purine-6-thione (CAS 7495-68-3), with molecular formula C9H12N4S and molecular weight 208.07826 g/mol. IUPAC: 7-butyl-3H-purine-6-thione.

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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.
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