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1724-02-3

1724-02-3 structural image
Product Name: Pent-2-ene-1,5-dioic acid
Formula: C5H6O4
Synonyms: 2-Pentenedioic acid
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 133 - 135 °C

COMPUTED DESCRIPTORS

Molecular Weight 130.10 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 130.02660867 g/mol
Monoisotopic Mass 130.02660867 g/mol
Topological Polar Surface Area 74.6 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 147
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Glutaconic acid is a pentenedioic acid that is pent-2-ene substituted by carboxy groups at positions 1 and 5. It has a role as a human metabolite. It is a conjugate acid of a glutaconate(1-).