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76-93-7

76-93-7 structural image
Product Name: Benzilic acid
Formula: C14H12O3
Synonyms: Benzilic acid;Diphenylglycolic acid
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid; [Merck Index] White to tan solid; [HSDB] White powder; [Sigma-Aldrich MSDS]
Color/Form White to tan powder
Odor Characteristic odor
Taste Bitter taste
Boiling Point 180 °C
Melting Point 150 °C
Solubility Very soluble in ethanol, ethyl ether; soluble concentrated sulfuric acid; slightly soluble in acetone
Vapor Pressure 0.00000002 [mmHg]
Decomposition When heated to decomposition it emits acrid smoke and irritating vapors.
Dissociation Constants pKa = 3.05 at 18 °C
Chemical Classes Other Classes -> Organic Acids

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P405:Store locked up.
P403+P233:Store in a well-ventilated place. Keep container tightly closed.

COMPUTED DESCRIPTORS

Molecular Weight 228.24 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 228.078644241 g/mol
Monoisotopic Mass 228.078644241 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 245
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

Benzilic acid is a 2-hydroxy monocarboxylic acid.