8-Phenyltheophylline
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8-Phenyltheophylline
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CAS No:
961-45-5
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Formula:
C13H12N4O2
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Chemical Name:
8-Phenyltheophylline
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Synonyms:
1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-phenyl-;Theophylline,8-phenyl-;1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-8-phenyl-;3,9-Dihydro-1,3-dimethyl-8-phenyl-1H-purine-2,6-dione;8-Phenyltheophylline;8-Phenyl-1,3-dimethylxanthine;1,3-Dimethyl-8-phenylxanthine;8-PT;3,7-Dihydro-1,3-dimethyl-8-phenyl-1H-purine-2,6-dione;NSC 14127;1,3-Dimethyl-8-phenyl-1H-purine-2,6(3H,7H)-dione
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CAS No:
Computed Properties
Molecular Weight:256.26
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:256.09602564
Monoisotopic Mass:256.09602564
Topological Polar Surface Area:69.3
Heavy Atom Count:19
Complexity:394
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes