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1H-Purine-2,6-dione, 8-cyclobutyl-3,4-dihydro-1,3-dimethyl- (9CI)

HCID 97136
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
35873-48-4
Standard SMILES
Cn1c(=O)c2[nH]c(C3CCC3)nc2n(C)c1=O
InChIKey
OBURDMXZDVFAKK-UHFFFAOYSA-N
Molecular formula
C11H14N4O2
Average molar mass
234.259 g/mol
Monoisotopic mass
234.11167569

Names & identifiers

Preferred name
1H-Purine-2,6-dione, 8-cyclobutyl-3,4-dihydro-1,3-dimethyl- (9CI)
IUPAC
8-Cyclobutyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
English name
8-Cyclobutyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione
Molecular formula
C11H14N4O2
Molecular weight
234.25

Names & synonyms

8-Cyclobutyltheophylline8-Cyclobutyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione1H-Purine-2,6-dione, 8-cyclobutyl-3,9-dihydro-1,3-dimethyl-

Database identifiers

CAS
35873-48-4
PubChem CID
97136
DTXSID
DTXSID10189431
ChEMBL
CHEMBL85185
UNII
2DCS7ZK0QZ
Nikkaji
J48.721J

Properties

Physicochemical properties

FDA UNII
2 DCS7ZK0QZ · 2DCS7ZK0QZ

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