3-ethyl-1-(6-hydroxy-6-methylheptyl)-7-propylpurine-2,6-dione
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3-ethyl-1-(6-hydroxy-6-methylheptyl)-7-propylpurine-2,6-dione
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CAS No:
134072-58-5
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Formula:
C18H30N4O3
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Chemical Name:
3-ethyl-1-(6-hydroxy-6-methylheptyl)-7-propylpurine-2,6-dione
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Synonyms:
3-ethyl-1-(6-hydroxy-6-methylheptyl)-7-propylxanthine; A90-6119; 1H-Purine-2,6-dione,3-ethyl-3,7-dihydro-1-(6-hydroxy-6-methylheptyl)-7-propyl;
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CAS No:
3-ethyl-1-(6-hydroxy-6-methylheptyl)-7-propylpurine-2,6-dione Basic Attributes
350.45600
350.23179083 g/mol
PEP50D97QG
DTXSID40158534
Computed Properties
Molecular Weight:350.5
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:350.23179083
Monoisotopic Mass:350.23179083
Topological Polar Surface Area:78.7
Heavy Atom Count:25
Complexity:483
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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