CAS 89796-99-6|Aceclofenac

Introduction:Basic information about CAS 89796-99-6|Aceclofenac, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameAceclofenac
CAS Number89796-99-6Molecular Weight354.185
Density1.5±0.1 g/cm3Boiling Point486.0±45.0 °C at 760 mmHg
Molecular FormulaC16H13Cl2NO4Melting Point149-153°C
MSDSChineseUSAFlash Point247.8±28.7 °C
Symbol
GHS06, GHS09
Signal WordDanger

Names

Nameaceclofenac
SynonymMore Synonyms

Aceclofenac BiologicalActivity

DescriptionAceclofenac is a non-steroidal anti-inflammatory drug (NSAID) analog of Diclofenac.Target: COXAceclofenac is a non-steroidal anti-inflammatory drug (NSAID) analog of Diclofenac. It is used for the relief of pain and inflammation in rheumatoid arthritis, osteoarthritis and ankylosing spondylitis. Aceclofenac has higher anti-inflammatory action than conventional NSAIDs. It is a cytokine inhibitor. Aceclofenac works by blocking the action of a substance in the body called cyclo-oxygenase. Cyclo-oxygenase is involved in the production of prostaglandins (chemicals in the body) which cause pain, swelling and inflammation. Aceclofenac is the glycolic acid ester of diclofenac [1].
Related CatalogResearch Areas >>Inflammation/Immunology
Target

COX-2:3 μM (IC50)

COX-1:7.3 μM (IC50)

References

[1]. Dannhardt G, et al. In-vitro test system for the evaluation of cyclooxygenase-1 (COX-1) and cyclooxygenase-2 (COX-2) inhibitors based on a single HPLC run with UV detection using bovine aortic coronary endothelial cells (BAECs). Inflamm Res. 2001 May;50(5):262-9.

Chemical & Physical Properties

Density1.5±0.1 g/cm3
Boiling Point486.0±45.0 °C at 760 mmHg
Melting Point149-153°C
Molecular FormulaC16H13Cl2NO4
Molecular Weight354.185
Flash Point247.8±28.7 °C
Exact Mass353.022156
PSA75.63000
LogP4.16
Vapour Pressure0.0±1.3 mmHg at 25°C
Index of Refraction1.639
InChIKeyMNIPYSSQXLZQLJ-UHFFFAOYSA-N
SMILESO=C(O)COC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
Storage condition-20°C Freezer

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CY1577900
CHEMICAL NAME :
Benzeneacetic acid, 2-((2,6-dichlorophenyl)amino)-, carboxymethyl ester
CAS REGISTRY NUMBER :
89796-99-6
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H13-Cl2-N-O4
MOLECULAR WEIGHT :
354.20

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
130 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 41,1265,1991

Safety Information

Symbol
GHS06, GHS09
Signal WordDanger
Hazard StatementsH301-H319-H410
Precautionary StatementsP273-P301 + P310-P305 + P351 + P338-P501
Hazard CodesXi
Risk PhrasesR36/37/38:Irritating to eyes, respiratory system and skin .
Safety PhrasesS26-S36
RIDADR2811.0
WGK Germany3
Hazard Class6.1
HS Code2922509090

Customs

HS Code2922509090
Summary2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Synonyms

Acelofenac
Aceclofenac
EINECS 205-783-4
Aceclofar
Preservex
MFCD00864296
Falcol
(2-{2-[(2,6-Dichlorophenyl)amino]phenyl}acetoxy)acetic acid
Tresquim
Biofenac
Zerodol
Airtal
PR-82/3
Benzeneacetic acid, 2-[(2,6-dichlorophenyl)amino]-, carboxymethyl ester
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