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


Chemical Name: 1,2-Pyrrolidinedicarboxylic acid, 1-(1,1-dimethylethyl) ester, (2S)-
CAS Number: 15761-39-4
Product Number: AG003OI7(AGN-PC-0O4HXP)
Synonyms:
MDL No: MFCD00037324
Molecular Formula: C10H17NO4
Molecular Weight: 215.2463

Identification/Properties


Properties
MP:
133-135 °C(lit.);
BP:
337.2°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
-60 ° (C=2, AcOH)
Solubility:
Soluble in acetic acid.
Computed Properties
Molecular Weight:
215.249g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
215.116g/mol
Monoisotopic Mass:
215.116g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
269
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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