1,2-Pyrrolidinedicarboxylic acid, 5-oxo-, 1-(1,1-dimethylethyl) ester,(2S)-


Chemical Name: 1,2-Pyrrolidinedicarboxylic acid, 5-oxo-, 1-(1,1-dimethylethyl) ester,(2S)-
CAS Number: 53100-44-0
Product Number: AG003CN9(AGN-PC-0SEDSM)
Synonyms:
MDL No: MFCD00672316
Molecular Formula: C10H15NO5
Molecular Weight: 229.2298

Identification/Properties


Properties
MP:
65-67 °C
BP:
425.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Stability:
Moisture Sensitive
Computed Properties
Molecular Weight:
229.232g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
229.095g/mol
Monoisotopic Mass:
229.095g/mol
Topological Polar Surface Area:
83.9A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
331
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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