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17119-15-2

17119-15-2 structural image
Product Name: 3-HYDROXYMANDELIC ACID
Formula: C8H8O4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Solubility 31 mg/mL

COMPUTED DESCRIPTORS

Molecular Weight 168.15 g/mol
XLogP3 -0.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 168.04225873 g/mol
Monoisotopic Mass 168.04225873 g/mol
Topological Polar Surface Area 77.8 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 168
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

3-hydroxymandelic acid is a 2-hydroxy monocarboxylic acid that is mandelic acid substituted by a hydroxy group at position 3'. It has a role as a human metabolite. It is a 2-hydroxy monocarboxylic acid and a member of phenols. It is functionally related to a mandelic acid.