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156-80-9

156-80-9 structural image
Product Name: propanedioate
Formula: C3H2O4(-2)
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CHEMICAL AND PHYSICAL PROPERTIES

Melting Point 135 dec °C
Solubility 763000 mg/L (at 25 °C)
LogP -0.81
Dissociation Constants 2.85 (at 25 °C)

COMPUTED DESCRIPTORS

Molecular Weight 102.05 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 101.99530854 g/mol
Monoisotopic Mass 101.99530854 g/mol
Topological Polar Surface Area 80.3 Ų
Heavy Atom Count 7
Formal Charge -2
Complexity 72.1
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

Malonate(2-) is a dicarboxylic acid dianion obtained by the deprotonation of the carboxy groups of malonic acid. It has a role as a human metabolite and a mitochondrial respiratory-chain inhibitor. It is a conjugate base of a malonate(1-).