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21149-26-8

21149-26-8 structural image
Product Name: 8-HYDROXYADENINE
Formula: C5H5N5O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid

COMPUTED DESCRIPTORS

Molecular Weight 151.13 g/mol
XLogP3 -1.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 151.04940980 g/mol
Monoisotopic Mass 151.04940980 g/mol
Topological Polar Surface Area 92.9 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 184
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

8-oxoadenine is an oxopurine that is adenine bearing a single oxo substituent at position 8. It has a role as a human metabolite. It is a member of 6-aminopurines, an oxopurine and a nucleobase analogue. It is functionally related to an adenine. It is a tautomer of an 8-hydroxyadenine.