6H-Purin-6-one, 1,9-dihydro-, 3-oxide
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6H-Purin-6-one, 1,9-dihydro-, 3-oxide
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CAS No:
19765-65-2
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Formula:
C5H4N4O2
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Chemical Name:
6H-Purin-6-one, 1,9-dihydro-, 3-oxide
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Synonyms:
6H-Purin-6-one,1,9-dihydro-,3-oxide;Hypoxanthine,3-oxide;6H-Purin-6-one,1,7-dihydro-,3-oxide;Purin-6-ol 3-oxide;Hypoxanthine 3-N-oxide;19039-47-5;19769-26-7
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CAS No:
Description
Hypoxanthine 3-N-oxide is an oxopurine that is 3,9-dihydro-6H-purine which is substituted by an oxo group at position 6 and in which the hydrogen attached to the nitrogen at position 3 is replaced by a hydroxy group. It is a major component of Schreckstoff, an alarm pheromone found in fish. It has a role as an alarm pheromone and a metabolite. It is a member of hydroxylamines, an oxopurine and a member of purine N-oxides.
Computed Properties
Molecular Weight:152.11
XLogP3:-0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:152.03342538
Monoisotopic Mass:152.03342538
Topological Polar Surface Area:81.6
Heavy Atom Count:11
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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