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6-(Propylthio)Purine
[CAS# 6288-93-3]

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Identification
Name 6-(Propylthio)Purine
Synonyms 6-(Propylthio)-7H-Purine; Ai3-50228; 1H-Purine, 6-(Propylthio)-
Molecular Structure CAS#: 6288-93-3, 6-(Propylthio)Purine
Molecular Formula C8H10N4S
Molecular Weight 194.25
CAS Registry Number 6288-93-3
SMILES C1=NC2=C(C(=N1)SCCC)[NH]C=N2
InChI 1S/C8H10N4S/c1-2-3-13-8-6-7(10-4-9-6)11-5-12-8/h4-5H,2-3H2,1H3,(H,9,10,11,12)
InChIKey BNLUVMLJJNTHSU-UHFFFAOYSA-N
Properties
Density 1.333g/cm3 (Cal.)
Boiling point 456.817°C at 760 mmHg (Cal.)
Flash point 230.075°C (Cal.)
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