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13231-00-0

13231-00-0 structural image
Product Name: 7,9-dihydro-1H-purine-6,8-dione
Formula: C5H4N4O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Solubility 0.167 mg/mL at 20 °C
LogP 0.246

COMPUTED DESCRIPTORS

Molecular Weight 152.11 g/mol
XLogP3 -1.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 152.03342538 g/mol
Monoisotopic Mass 152.03342538 g/mol
Topological Polar Surface Area 82.6 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 304
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

6,8-Dihydroxypurine is an oxopurine.