2868258-96-0

Name 1-Pyrrolidinecarboxylic acid, 3-(2-bromoacetyl)-4-ethyl-, phenylmethyl ester, (3S,4S)-
CAS 2868258-96-0
Molecular Formula C16H20BrNO3
Molecular Weight 354.24
MOL File 2868258-96-0.mol
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Chemical Properties

Boiling point  453.1±45.0 °C(Predicted)
density  1.361±0.06 g/cm3(Predicted)
pka -2.91±0.60(Predicted)
InChI InChI=1S/C16H20BrNO3/c1-2-13-9-18(10-14(13)15(19)8-17)16(20)21-11-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11H2,1H3/t13-,14-/m1/s1
InChIKey QEFUCTKHMXMWRF-ZIAGYGMSSA-N
SMILES N1(C(OCC2=CC=CC=C2)=O)C[C@@H](CC)[C@H](C(CBr)=O)C1

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