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CAS Number: 72130-68-8
ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate

Structure

ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate
Name: ethyl 7-hydroxy-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate
Synonyms:
General Information
Product Number: 72130688
CAS Registry Number: 72130-68-8
Name:
8-​Indolizinecarboxylic acid, 1,​2,​3,​5-​tetrahydro-​7-​hydroxy-​5-​oxo-​, ethyl ester
 
Chemical Formula: C11H13NO4
Exact Mass: 223.08
Molecular Weight: 223.23
m/z: 223.08 (100.0%), 224.09 (12.2%), 225.09 (1.5%)
Elemental Analysis: C, 59.19; H, 5.87; N, 6.27; O, 28.67
 
InChI: InChI=1S/C11H13NO4/c1-2-16-11(15)10-7-4-3-5-12(7)9(14)6-8(10)13/h6,13H,2-5H2,1H3
InChIKey: NWSKLPDPUFBJDU-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=C2CCCN2C(=O)C=C1O
 
Thermal Properties Value Condition Note
Melting Point 131 °C Solv: ethyl ether (60-29-7) (1)IC
Melting Point 130 °C   (2)IC

Specification

98%

References
  1. (1) Celerier, Jean Pierre; Journal of Heterocyclic Chemistry 1979, V16(5), P953-5 CAPLUS
  2. (2) Dannhardt, Gerd; European Journal of Medicinal Chemistry 1987, V22(6), P505-10 CAPLUS
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