463485

Methylisonipecotat

technical grade

• Synonym(e): Piperidin-4-carbonsäure-methylester
• Empirische Formel (Hill-System): C₇H₁₃NO₂
• CAS-Nummer: 2971-79-1
• Molekulargewicht: 143.18
• MDL-Nummer: MFCD00190578
• UNSPSC-Code: 12352100
• PubChem Substanz-ID: 24870073
• NACRES: NA.22

Eigenschaften

• Qualität: technical grade
• Qualitätsniveau: 100
• Brechungsindex: n20/D 1.465 (lit.)
• bp: 85-90 °C (lit.)
• Dichte: 1.06 g/mL at 25 °C (lit.)
• Funktionelle Gruppe: ester
• SMILES String: COC(=O)C1CCNCC1
• InChI: 1S/C7H13NO2/c1-10-7(9)6-2-4-8-5-3-6/h6,8H,2-5H2,1H3
• InChIKey: RZVWBASHHLFBJF-UHFFFAOYSA-N

Beschreibung

Allgemeine Beschreibung

Methyl isonipecotate can be obtained by the reduction of methyl isonicotinate in methanol with ruthenium at 100-150°C.

Anwendung

Precipitate may form upon standing which should not affect application.

Methyl isonipecotate may be used for the synthesis of a series of potent non-urea soluble epoxide hydrolase (sEH) inhibitors via high throughput screens.

Reactant for C-2 arylation of piperidines through directed transition metal-catalyzed sp3 C-H activation

Reactant for synthesis of:
Antitubercular agents
Anti-HIV-1 agents
Aminopyrazine inhibitors
Orally available naphthyridine protein kinase D inhibitors
A Scalable catalyst from asymmetric hydrogenation of sterically demanding aryl enamide

Sicherheitshinweise

• Piktogramme: GHS07
• Signalwort: Warning
• H-Sätze: H315,H319,H335
• P-Sätze: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Gefahreneinstufungen: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Zielorgane: Respiratory system
• Lagerklassenschlüssel: 10 - Combustible liquids
• WGK: WGK 3
• Flammpunkt (°F): 192.2 °F - closed cup
• Flammpunkt (°C): 89 °C - closed cup
• Persönliche Schutzausrüstung: Eyeshields, Gloves, type ABEK (EN14387) respirator filter