194360

Ethyl nipecotate

96%

• Synonym(s): 3-Piperidinecarboxylic acid ethyl ester, Ethyl 3-piperidinecarboxylate, NSC 158451
• Empirical Formula (Hill Notation): C₈H₁₅NO₂
• CAS Number: 5006-62-2
• Molecular Weight: 157.21
• Beilstein/REAXYS Number: 118388
• EC Number: 225-681-3
• MDL number: MFCD00005991
• UNSPSC Code: 12352100
• PubChem Substance ID: 24851647
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: 96%
• form: liquid
• refractive index: n20/D 1.460 (lit.)
• bp: 102-104 °C/7 mmHg (lit.)
• density: 1.012 g/mL at 25 °C (lit.)
• functional group: ester
• SMILES string: CCOC(=O)C1CCCNC1
• InChI: 1S/C8H15NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h7,9H,2-6H2,1H3
• InChI key: XIWBSOUNZWSFKU-UHFFFAOYSA-N

Description

Application

Ethyl nipecotate was used in the synthesis of:

• α,α′-bis[3-(N,N-diethylcarbamoyl)-piperidino]-p-xylene
• 2-amino-4-thiazolyl derivative of 3-(iso-propyl-3-piperidinyl)phenol

Reactant for synthesis of:
Squalene synthase inhibitors
4-aminomethyl-7,8-dihydroxycoumarines and their crown ether derivatives
Spiroimidazolidinone NPC1L1 inhibitors
Quorum sensing modulators
Selective serotonin 5-HT6 receptor antagonists
Oxazolidinone RNA-binding agents

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 10 - Combustible liquids
• flash_point_f: 195.8 °F - closed cup
• flash_point_c: 91 °C - closed cup
• ppe: Eyeshields, Gloves, type ABEK (EN14387) respirator filter