8-Cyclopropyl-1,3-dimethyl-7H-purine-2,6-dione

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Catalog Number
ACM35873473
Product Name
8-Cyclopropyl-1,3-dimethyl-7H-purine-2,6-dione
Structure
Structure
CAS
35873-47-3
Category
Heterocyclic Organic Compound
Synonyms
Xanthine,8-cyclopropyl-1,3-dimethyl; 8-Cyclopropyltheophylline; 8-cyclopropyl-1,3-dimethyl-3,9-dihydro-1h-purine-2,6-dione; 8-Cyclopropyltheophyllin; 8-cyclopropyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione; Theophylline,8-cyclopropyl;
IUPAC Name
8-cyclopropyl-1,3-dimethyl-7H-purine-2,6-dione
Molecular Weight
220.228 g/mol
Molecular Formula
C10H12N4O2
Canonical SMILES
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CC3
InChI Key
SZMWFUBOZRDQPO-UHFFFAOYSA-N
Boiling Point
506.8ºC at 760 mmHg
Flash Point
260.3ºC
Density
1.459g/cm³
Exact Mass
220.09600
H-Bond Acceptor
3
H-Bond Donor
1
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