6-(Methylthio)-1H-pyrazolo[3,4]pyrimidine
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![6-(Methylthio)-1H-pyrazolo[3,4]pyrimidine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0e300298011e47808d28e44e352ec25c.png "6-(Methylthio)-1H-pyrazolo[3,4]pyrimidine")
6-(Methylthio)-1H-pyrazolo[3,4]pyrimidine
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CAS No:
55084-74-7
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Formula:
C6H6N4S
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Chemical Name:
6-(Methylthio)-1H-pyrazolo[3,4]pyrimidine
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Synonyms:
6-(Methylthio)-1H-pyrazolo[3,4]pyrimidine;6-(Methylthio)-1H-pyrazolo[3,4-d]pyriMidine;4-[1-(Methylsulfanyl)-1H-pyrazol-3-yl]pyriMidine;6-(Methylthio)-1H-pyrazol...;6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine;6-(Methythio)-1H-pyrazolo[3,4-d]pyrimidine;1H-Pyrazolo[3,4-d]pyrimidine, 6-(methylthio)-
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CAS No:
Characteristics
1.59±0.1 g/cm3
210-212 °C(Solv: ethanol, 80% (64-17-5))
318.3±25.0 °C(Predicted)
10.09±0.20
Computed Properties
Molecular Weight:166.21
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:166.03131738
Monoisotopic Mass:166.03131738
Topological Polar Surface Area:79.8
Heavy Atom Count:11
Complexity:143
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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