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CAS Number: 24228-40-8
ethyl 1-benzylpiperidine-4-carboxylate

Structure

ethyl 1-benzylpiperidine-4-carboxylate
Name: ethyl 1-benzylpiperidine-4-carboxylate
Synonyms:
General Information
Product Number: 24228408
CAS Registry Number: 24228-40-8
Name:
        4-​Piperidinecarboxylic acid, 1-​(phenylmethyl)​-​, ethyl ester
        Isonipecotic acid, 1-​benzyl-​, ethyl ester (8CI); 1-​(Phenylmethyl)​piperidine-​4-​carboxylic acid ethyl ester; 1-​Benzyl-​4-​carboethoxypiperidin​e; 1-​Benzyl-​piperidine-​4-​carboxylic acid ethyl ester; Ethyl 1-​benzylisonipecotate; Ethyl 1-​benzylpiperidine-​4-​carboxylate; Ethyl N-​benzylisonipecotate; Ethyl N-​benzylisonipecotinat​e 
 
Chemical Formula: C15H21NO2
Exact Mass: 247.16
Molecular Weight: 247.33
m/z: 247.16 (100.0%), 248.16 (16.5%), 249.16 (1.7%)
Elemental Analysis: C, 72.84; H, 8.56; N, 5.66; O, 12.94
 
InChI: InChI=1S/C15H21NO2/c1-2-18-15(17)14-8-10-16(11-9-14)12-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3
InChIKey: ASQCOPJFYLJCGD-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1CCN(CC1)CC2=CC=CC=C2

Specification

98%

References
  1. (1) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  2. (2) Jansen, Michaela; Journal of Medicinal Chemistry 2008, V51(15), P4430-4448 CAPLUS
  3. (3) Caruso, Anna; Pharmacologyonline 2009, (1), P264-277 CAPLUS
  4. (4) Niphade, Navanath; Organic Process Research & Development 2008, V12(4), P731-735 CAPLUS
  5. (5) Barbe, Guillaume; Journal of the American Chemical Society 2008, V130(1), P18-19 CAPLUS
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