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89796-99-6

89796-99-6 structural image
Product Name: Aceclofenac
Formula: C16H13Cl2NO4
Synonyms: 2-[(2,6-Dichlorophenyl)amino]benzeneacetic acid carboxymethyl ester;;Aceclofenac
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CHEMICAL AND PHYSICAL PROPERTIES

Melting Point 149-153
Solubility >53.1 [ug/mL] (The mean of the results at pH 7.4)
LogP 2.17

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H301:Acute toxicity,oral
H319:Serious eye damage/eye irritation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
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 354.2 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 353.0221633 g/mol
Monoisotopic Mass 353.0221633 g/mol
Topological Polar Surface Area 75.6 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 411
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

Aceclofenac is a monocarboxylic acid that is the carboxymethyl ester of diclofenac. It is an oral, biologically active non-steroidal anti-inflammatory drug (NSAID) with significant anti-inflammatory and analgesic properties for the treatment of osteoarthritis, rheumatoid arthritis and ankylosing spondylitis.

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