E33505

Ethyl isonipecotate

98%

• Synonym(s): Ethyl 4-piperidinecarboxylate, Piperidin-4-carboxylic acid ethyl ester
• Empirical Formula (Hill Notation): C₈H₁₅NO₂
• CAS Number: 1126-09-6
• Molecular Weight: 157.21
• Beilstein/REAXYS Number: 118419
• EC Number: 214-416-7
• MDL number: MFCD00006003
• UNSPSC Code: 12352100
• PubChem Substance ID: 24894508
• NACRES: NA.22

Properties

• assay: 98%
• form: liquid
• refractive index: n20/D 1.459 (lit.)
• bp: 204 °C (lit.)
• density: 1.02 g/mL at 25 °C (lit.)
• SMILES string: CCOC(=O)C1CCNCC1
• InChI: 1S/C8H15NO2/c1-2-11-8(10)7-3-5-9-6-4-7/h7,9H,2-6H2,1H3
• InChI key: RUJPPJYDHHAEEK-UHFFFAOYSA-N

Description

Application

Reactant for synthesis of:

• SMN protein modulators
• β-aryl and β-amino-substituted aliphatic esters by rhodium catalyzed tandem double bond migration/conjugate addition
• Nitroethylenediamines by nucleophilic ring opening of nitroimidazolidinone
• RhoA inhibitors for cardiovascular disease therapy
• Saccharin derived Mannich bases as antimicrobials and antioxidants

Reactant for one-pot reductive amination and Suzuki-Miyaura cross coupling of formyl aryl and heteroaryl MIDA boronates

Safety Information

• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 176.0 °F - closed cup
• flash_point_c: 80 °C - closed cup
• ppe: Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)