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17199-29-0

17199-29-0 structural image
Product Name: (S)-(+)-Mandelic acid
Formula: C8H8O3
Synonyms: (S)-α-Hydroxyphenylacetic acid;(S)-(+)-Mandelic acid;L-Mandelic acid, L-α-Hydroxyphenylacetic acid
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Off-white or white powder; [Alfa Aesar MSDS]
Melting Point 119 °C
Solubility 181000 mg/L (at 25 °C)
LogP 0.62
Dissociation Constants 3.41 (at 25 °C)
Collision Cross Section 130.6 Ų [M-H]-
Chemical Classes Other Classes -> Organic Acids

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05
GHS Hazard Statements H318:Serious eye damage/eye irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 152.15 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 152.047344113 g/mol
Monoisotopic Mass 152.047344113 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 138
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)-mandelic acid is a (2S)-2-hydroxy monocarboxylic acid and a mandelic acid. It is a conjugate acid of a (S)-mandelate. It is an enantiomer of a (R)-mandelic acid.

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Noble Molecular Research

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