1-Pyrrolidinecarboxylic acid, 2-(aminocarbonyl)-, phenylmethyl ester,(2S)-


Chemical Name: 1-Pyrrolidinecarboxylic acid, 2-(aminocarbonyl)-, phenylmethyl ester,(2S)-
CAS Number: 34079-31-7
Product Number: AG00I6QC(AGN-PC-0R9J0R)
Synonyms:
MDL No:
Molecular Formula: C13H16N2O3
Molecular Weight: 248.2777

Identification/Properties


Computed Properties
Molecular Weight:
248.282g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
248.116g/mol
Monoisotopic Mass:
248.116g/mol
Topological Polar Surface Area:
72.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
313
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
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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