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CAS Number: 5747-92-2
ethyl 1-benzylpyrrolidine-3-carboxylate

Structure

ethyl 1-benzylpyrrolidine-3-carboxylate
Name: ethyl 1-benzylpyrrolidine-3-carboxylate
Synonyms:
General Information
Product Number: 5747922
CAS Registry Number: 5747-92-2
Name:
        3-​Pyrrolidinecarboxyli​c acid, 1-​(phenylmethyl)​-​, ethyl ester
        3-​Pyrrolidinecarboxyli​c acid, 1-​benzyl-​, ethyl ester (7CI,​8CI); 1-​Benzylpyrrolidine-​3-​carboxylic acid ethyl ester; Ethyl 1-​benzylpyrrolidine-​3-​carboxylate; Ethyl N-​benzylpyrrolidine-​3-​carboxylate 
        Deleted CAS Registry Numbers: 141453-​89-​6
 
Chemical Formula: C14H19NO2
Exact Mass: 233.14
Molecular Weight: 233.31
m/z: 233.14 (100.0%), 234.14 (15.5%), 235.15 (1.5%)
Elemental Analysis: C, 72.07; H, 8.21; N, 6.00; O, 13.72
 
InChI: InChI=1S/C14H19NO2/c1-2-17-14(16)13-8-9-15(11-13)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3
InChIKey: CYPXEPWPTXKUPL-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1CCN(C1)CC2=CC=CC=C2
 
Thermal Properties Value Condition Note
Boiling Point 125-127 °C Press: 1 Torr (1)IC
Boiling Point 118-120 °C Press: 0.75 Torr (2)CAS
 

Specification

98%

References

  • (1) Delaney, Edward J.; Journal of the American Chemical Society 1982, V104(3), P799-807 CAPLUS
  • (2) Mizzoni, Renat H.; BE 654416 1965 CAPLUS
  • (3) Srihari, Pabbaraja; Synthesis 2006, (16), P2646-2648 CAPLUS
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