7-(3-aminooxypropyl)-1,3-dimethylpurine-2,6-dione,hydrochloride
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7-(3-aminooxypropyl)-1,3-dimethylpurine-2,6-dione,hydrochloride
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CAS No:
59663-17-1
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Formula:
C10H16ClN5O3
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Chemical Name:
7-(3-aminooxypropyl)-1,3-dimethylpurine-2,6-dione,hydrochloride
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Synonyms:
7-(3-aminooxypropyl)-1,3-dimethylpurine-2,6-dione hydrochloride; 1H-Purine-2,6-dione,3,7-dihydro-7-(3-(aminooxy)propyl)-1,3-dimethyl-,hydrochloride; Theophylline,7-(3-(aminooxy)propyl)-,monohydrochloride;
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CAS No:
7-(3-aminooxypropyl)-1,3-dimethylpurine-2,6-dione,hydrochloride Basic Attributes
289.71900
289.0941671
DTXSID30208350
Computed Properties
Molecular Weight:289.72
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:289.0941671
Monoisotopic Mass:289.0941671
Topological Polar Surface Area:93.7
Heavy Atom Count:19
Complexity:350
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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