1,2-Pyrrolidinedicarboxylic acid, 1-(phenylmethyl) ester, (2R)-


Chemical Name: 1,2-Pyrrolidinedicarboxylic acid, 1-(phenylmethyl) ester, (2R)-
CAS Number: 6404-31-5
Product Number: AG003BDG(AGN-PC-0OEJEZ)
Synonyms:
MDL No:
Molecular Formula: C13H15NO4
Molecular Weight: 249.2625

Identification/Properties


Properties
MP:
76-78 °C(lit.)
BP:
432.3°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
40 ° (C=2, EtOH)
Computed Properties
Molecular Weight:
249.266g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
249.1g/mol
Monoisotopic Mass:
249.1g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
312
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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