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612-37-3

612-37-3 structural image
Product Name: 7-METHYLURIC ACID
Formula: C6H6N4O3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Collision Cross Section 129.35 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]

COMPUTED DESCRIPTORS

Molecular Weight 182.14 g/mol
XLogP3 -1.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 182.04399007 g/mol
Monoisotopic Mass 182.04399007 g/mol
Topological Polar Surface Area 90.5 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 359
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

7-Methyluric acid is an oxopurine.