1,3-Piperazinedicarboxylic acid, 3-methyl 1-(phenylmethyl) ester, (3S)-


Chemical Name: 1,3-Piperazinedicarboxylic acid, 3-methyl 1-(phenylmethyl) ester, (3S)-
CAS Number: 225517-81-7
Product Number: AG006XKM(AGN-PC-0O80XX)
Synonyms:
MDL No:
Molecular Formula: C14H18N2O4
Molecular Weight: 278.3037

Identification/Properties


Properties
BP:
406.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Computed Properties
Molecular Weight:
278.308g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
278.127g/mol
Monoisotopic Mass:
278.127g/mol
Topological Polar Surface Area:
67.9A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
342
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

Safety Information


NMR Spectrum


Other Analytical Data


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