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6-(Hexylthio)-9H-purine

6-(Hexylthio)-9H-purine structure

CAS No:
37109-78-7
Formula:
C11H16N4S
Chemical Name:
6-(Hexylthio)-9H-purine
Synonyms:
9H-Purine,6-(hexylthio)-;1H-Purine,6-(hexylthio)-;Purine,6-(hexylthio)-;6-(Hexylthio)-9H-purine;6-Hexylmercaptopurine;6-n-Hexylmercaptopurine;NSC 22776

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6-(Hexylthio)-9H-purine Basic Attributes

Molecular Weight：

236.34 g/mol

Exact Mass：

236.34

EC Number：

253-352-4

NSC Number：

22776

DSSTox ID：

DTXSID90190606

Characteristics

PSA：

79.8 Å²

Melting Point：

98-99 °C @ Solvent: Ethanol, 50%

Computed Properties

Molecular Weight:236.34
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:236.10956770
Monoisotopic Mass:236.10956770
Topological Polar Surface Area:79.8
Heavy Atom Count:16
Complexity:202
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(Hexylthio)-9H-purine

Basic Attributes
Characteristics
Computed Properties

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