Diclofenac Potassium - ≥99% , Cyclooxygenase inhibitor, CAS No.15307-81-0, Cyclooxygenase inhibitor

CAS: 15307-81-0 Cat. No.: D129413 Formula: C₁₄H₁₀Cl₂KNO₂ Peso molecolare: 334.24 Numero EC: 630-422-6 PubChem CID: 23667642

GRADE & PURITY ≥99%

Synonyms

Diclofenac potassium (USP) | Tox21_110258 | Benzeneacetic acid, 2-((2,6-dichlorophenyl)amino)-, monopotassium salt | D00903 | DICLOFENAC POTASSIUM (USP-RS) | DICLOFENAC POTASSIUM [ORANGE BOOK] | DICLOFENAC POTASSIUM [USP MONOGRAPH] | Q27106401 | Cataflam

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinonimi

Diclofenac potassium (USP) | Tox21_110258 | Benzeneacetic acid, 2-((2,6-dichlorophenyl)amino)-, monopotassium salt | D00903 | DICLOFENAC POTASSIUM (USP-RS) | DICLOFENAC POTASSIUM [ORANGE BOOK] | DICLOFENAC POTASSIUM [USP MONOGRAPH] | Q27106401 | Cataflam

Specifiche e purezza

≥99%

Condizioni di conservazione di stoccaggio

Store at -20°C

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Tipo di azione

INHIBITOR

Meccanismo d'azione

Cyclooxygenase inhibitor

Purezza

≥99%

Nomi e identificatori

Pubchem Sid

488200429

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488200429

Sorrisi canonici

C1=CC=C(C(=C1)CC(=O)[O-])NC2=C(C=CC=C2Cl)Cl.[K+]

IUPAC Name

potassium;2-[2-(2,6-dichloroanilino)phenyl]acetate

InChIKey

KXZOIWWTXOCYKR-UHFFFAOYSA-M

INCHI

1S/C14H11Cl2NO2.K/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19;/h1-7,17H,8H2,(H,18,19);/q;+1/p-1

Isomeri SMILES

C1=CC=C(C(=C1)CC(=O)[O-])NC2=C(C=CC=C2Cl)Cl.[K+]

PubChem CID

23667642

Peso molecolare

334.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Level5 Chlorobenzenes
          • Level6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: Aniline and substituted anilines Aryl chlorides Carboxylic acid salts Amino acids Secondary amines Organic metal halides Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organochlorides Organic zwitterions Organic potassium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - 1,3-dichlorobenzene - Aryl chloride - Aryl halide - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Organic metal halide - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Monocarboxylic acid or derivatives - Secondary amine - Amine - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic zwitterion - Organic salt - Organic potassium salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• External Descriptors: potassium salt

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Obiettivi associati (non umani)

Mus musculus (284745 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: DMSO 69 mg/mL Water 10 mg/mL Ethanol <1 mg/mL
• Peso molecolare: 334.200 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 332.973 Da
• Monoisotopic Mass: 332.973 Da
• Topological Polar Surface Area: 52.200 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 310.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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