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Structure

8-bromo-1,3,7-trimethylpurine-2,6-dione

CAS
10381-82-5
Catalog Number
ACM10381825
Category
Other Products
Molecular Weight
273.087 g/mol
Molecular Formula
C8H9BrN4O2

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Specification

Synonyms
Xanthobin; 8-Brom-3,7-dihydro-1,3,7-trimethyl-1H-purin-2,6-dion; Caffeine,8-bromo; 8-Caffeine bromide; 8-Bromocaffeine; 8-bromo-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione; Xanthobine; 8-bromo-1,3,7-trimethyl-xanthine; 8-Bromo-1,3,7-trimethyl-3,7-dihy
IUPAC Name
8-bromo-1,3,7-trimethylpurine-2,6-dione
Canonical SMILES
CN1C2=C(N=C1Br)N(C(=O)N(C2=O)C)C
InChI Key
YRLRORFORQUTKS-UHFFFAOYSA-N
Exact Mass
271.99100
H-Bond Acceptor
3
H-Bond Donor
0
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