Furprofen - ≥99% , CAS No.66318-17-0

CAS: 66318-17-0 Cat. No.: F649917 Summenformel: C₁₄H₁₂O₄ Molekulargewicht: 244.24 PubChem CID: 162201

GRADE & PURITY ≥99%

Synonyms

2-[4-(furan-2-carbonyl)phenyl]propanoic acid | DTXSID20984893 | AKOS040733209 | MS-23453 | Benzeneacetic acid, 4-(2-furanylcarbonyl)-alpha-methyl- | UNII-WN6TVW60GV | 4-(2-FURANYLCARBONYL)-.ALPHA.-METHYLBENZENEACETIC ACID | FURPROFEN [MART.] | 2-(4-(2-FUR

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

Furprofen is an non-steroidal anti-inflammatory drug (NSAID) with analgesic properties Furprofen acts via the inhibition of prostaglandin (PGE) synthesis . Furprofen can be treated orally for the relief of pain

Form:Oil

IC50& Target:PGE

Specifications

Synonyme

2-[4-(furan-2-carbonyl)phenyl]propanoic acid | DTXSID20984893 | AKOS040733209 | MS-23453 | Benzeneacetic acid, 4-(2-furanylcarbonyl)-alpha-methyl- | UNII-WN6TVW60GV | 4-(2-FURANYLCARBONYL)-.ALPHA.-METHYLBENZENEACETIC ACID | FURPROFEN [MART.] | 2-(4-(2-FUR

Spezifikationen & Reinheit

≥99%

Biochemische und physiologische Mechanismen

Furprofen is an non-steroidal anti-inflammatory drug (NSAID) with analgesic properties. Furprofen acts via the inhibition of prostaglandin (PGE) synthesis . Furprofen can be treated orally for the relief of pain.

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

INHIBITOR

Reinheit

≥99%

Namen und Kennungen

Kanonisches Lächeln

CC(C1=CC=C(C=C1)C(=O)C2=CC=CO2)C(=O)O

IUPAC Name

2-[4-(furan-2-carbonyl)phenyl]propanoic acid

InChIKey

ITJUVDBADHDNPU-UHFFFAOYSA-N

INCHI

1S/C14H12O4/c1-9(14(16)17)10-4-6-11(7-5-10)13(15)12-3-2-8-18-12/h2-9H,1H3,(H,16,17)

Isomere SMILES

CC(C1=CC=C(C=C1)C(=O)C2=CC=CO2)C(=O)O

Alternative CAS-Nummer

66318-17-0

PubChem CID

162201

MeSH-Eintrag

2-(4-phenyl-(2'-furoyl))propionic acid;furprofen

Molekulargewicht

244.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Carbonyl compounds
        • Ebene5 Ketones
          • Ebene6 Aryl ketones
            • Ebene7 Phenylketones
              • Ebene8 Aryl-phenylketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones - Aryl ketones - Phenylketones
• Direct Parent: Aryl-phenylketones
• Alternative Parents: Phenylpropanoic acids Monocyclic monoterpenoids Aromatic monoterpenoids Benzoyl derivatives Heteroaromatic compounds Furans Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl-phenylketone - 2-phenylpropanoic-acid - Monoterpenoid - Monocyclic monoterpenoid - Aromatic monoterpenoid - P-cymene - Benzoyl - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Furan - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
• External Descriptors: Not available

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

Chemische und physikalische Eigenschaften

• Löslichkeit: Ethanol : 100 mg/mL (409.43 mM; Need ultrasonic) DMSO : 62.5 mg/mL (255.90 mM; Need ultrasonic)
• Molekulargewicht: 244.240 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 244.074 Da
• Monoisotopic Mass: 244.074 Da
• Topological Polar Surface Area: 67.500 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 318.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 66318-17-0, the molecular formula is C14H12O4, and the molecular weight is 244.24 g/mol. InChIKey ITJUVDBADHDNPU-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.