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1,2,3,7-Tetrahydro-2-thioxo-6H-purin-6-one

CAS
2487-40-3
Catalog Number
ACM2487403
Category
Other Products
Molecular Weight
168.18
Molecular Formula
C5H4N4OS

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Specification

Synonyms
2-Thioxanthine, 2-Thioxanthene, Purine analog, 2-Thiohypoxanthine, Xanthine, 2-thio-, 6-Hydroxy-2-mercaptopurine, 2-Thio-6-oxypurine, 6-Hydroxypurine-2-thiol, 2-Mercapto-6-hydroxypurine, Ambap591, 2-THIOXANTHANE, Xanthine, 2-thio- (VAN), Xanthine, 2-thio- (8CI), EINECS 219-636-7, NSC 36822, NSC680828, AIDS023031, AIDS045526, NSC 680828, AIDS-023031
IUPAC Name
2-sulfanylidene-3,7-dihydropurin-6-one
Canonical SMILES
C1=NC2=C(N1)C(=O)NC(=S)N2
InChI Key
XNHFAGRBSMMFKL-UHFFFAOYSA-N
Melting Point
>300ºC
Density
1.78g/cm³
EC Number
219-636-7
Exact Mass
168.01100
H-Bond Acceptor
3
H-Bond Donor
3
Safety Description
26-37
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