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CAS Number: 17012-21-4
methyl 1-benzylpyrrolidine-3-carboxylate

Structure

methyl 1-benzylpyrrolidine-3-carboxylate
Name: methyl 1-benzylpyrrolidine-3-carboxylate
Synonyms:
General Information
Product Number: 17012214
CAS Registry Number: 17012-21-4
Name:
3-​Pyrrolidinecarboxyli​c acid, 1-​(phenylmethyl)​-​, methyl ester
3-​Pyrrolidinecarboxyli​c acid, 1-​benzyl-​, methyl ester (6CI,​8CI); 1-​Benzylpyrrolidine-​3-​carboxylate methyl ester; 1-​Benzylpyrrolidine-​3-​carboxylic acid methyl ester; Methyl 1-​benzyl-​3-​pyrrolidinecarboxyla​te 
Deleted CAS Registry Numbers: 126344-​02-​3
 
Chemical Formula: C13H17NO2
Exact Mass: 219.13
Molecular Weight: 219.28
m/z: 219.13 (100.0%), 220.13 (14.3%), 221.13 (1.4%)
Elemental Analysis: C, 71.21; H, 7.81; N, 6.39; O, 14.59
 
InChI: InChI=1S/C13H17NO2/c1-16-13(15)12-7-8-14(10-12)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
InChIKey: GDWFCUOFVSNTTG-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1CCN(C1)CC2=CC=CC=C2
 
Thermal Properties Value Condition Note
Boiling Point 104-105 °C Press: 4 Torr (1)IC

Specification

98%

References
  1. (1) Terao, Yoshiyasu; Chemical & Pharmaceutical Bulletin 1985, V33(7), P2762-6 CAPLUS
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