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2174-58-5

2174-58-5 structural image
Product Name: (S)-(-)-Methylsuccinic acid
Formula: C5H8O4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 117.5 °C
Solubility 516.5 mg/mL

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 132.11 g/mol
XLogP3 -0.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 132.04225873 g/mol
Monoisotopic Mass 132.04225873 g/mol
Topological Polar Surface Area 74.6 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 129
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

(S)-methylsuccinic acid is a 2-methylbutanedioic acid in which the methyl group at position 2 has S-configuration. It is a conjugate acid of a (2S)-methylsuccinate(2-). It is an enantiomer of a (R)-methylsuccinic acid.