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CAS Number: 53074-96-7
ethyl 2-oxo-2-(piperidin-1-yl)acetate

Structure

ethyl 2-oxo-2-(piperidin-1-yl)acetate
Name: ethyl 2-oxo-2-(piperidin-1-yl)acetate
Synonyms:
General Information
Product Number: 53074967
CAS Registry Number: 53074-96-7
Name:
1-​Piperidineacetic acid, α-​oxo-​, ethyl ester
1-​Piperidineglyoxylic acid, ethyl ester (6CI) 
 
Chemical Formula: C9H15NO3
Exact Mass: 185.11
Molecular Weight: 185.22
m/z: 185.11 (100.0%), 186.11 (10.0%), 187.11 (1.1%)
Elemental Analysis: C, 58.36; H, 8.16; N, 7.56; O, 25.91
 
InChI: InChI=1S/C9H15NO3/c1-2-13-9(12)8(11)10-6-4-3-5-7-10/h2-7H2,1H3
InChIKey: ASBDXHCMVYVJQQ-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C(=O)N1CCCCC1
 
Thermal Properties Value Condition Note
Boiling Point 92-96 °C Press: 0.25 Torr (1)IC
Boiling Point 75 °C Press: 0.05 Torr (2)CAS
 

Specification

98%

References
  1. (1) Sellstedt, John H.; Journal of Medicinal Chemistry 1975, V18(9), P926-33 CAPLUS
  2. (2) Ungnade, H. E.; Journal of Organic Chemistry 1959, V24, P666-8 CAPLUS
  3. (3) Gaudin, Jean-Marc; Chemistry & Biodiversity 2008, V5(4), P617-635 CAPLUS
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