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1-hydroxy-7-methyl-8-methylsulfanyl-3H-purine-2,6-dione

1-hydroxy-7-methyl-8-methylsulfanyl-3H-purine-2,6-dione structure

CAS No:
1080-62-2
Formula:
C7H8N4O3S
Chemical Name:
1-hydroxy-7-methyl-8-methylsulfanyl-3H-purine-2,6-dione
Synonyms:
1080-62-2;NSC85704;1-hydroxy-7-methyl-8-(methylsulfanyl)-3,7-dihydro-1h-purine-2,6-dione;DTXSID50292817;NSC-85704

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1-hydroxy-7-methyl-8-methylsulfanyl-3H-purine-2,6-dione Basic Attributes

Molecular Weight：

228.23 g/mol

Exact Mass：

228.03171130 g/mol

NSC Number：

85704

DSSTox ID：

DTXSID50292817

Characteristics

PSA：

113 Å²

Computed Properties

Molecular Weight:228.23
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:228.03171130
Monoisotopic Mass:228.03171130
Topological Polar Surface Area:113
Heavy Atom Count:15
Complexity:313
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-hydroxy-7-methyl-8-methylsulfanyl-3H-purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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