3-Pyrrolidinecarboxylic acid, 5-oxo-1-(phenylmethyl)-, methyl ester


Chemical Name: 3-Pyrrolidinecarboxylic acid, 5-oxo-1-(phenylmethyl)-, methyl ester
CAS Number: 51535-00-3
Product Number: AG00DEO6(AGN-PC-0JM3B5)
Synonyms:
MDL No: MFCD00003196
Molecular Formula: C13H15NO3
Molecular Weight: 233.2631

Identification/Properties


Computed Properties
Molecular Weight:
233.267g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
233.105g/mol
Monoisotopic Mass:
233.105g/mol
Topological Polar Surface Area:
46.6A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
297
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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