1,2-Pyrrolidinedicarboxylicacid, 4,4-dimethyl-5-oxo-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-


Chemical Name: 1,2-Pyrrolidinedicarboxylicacid, 4,4-dimethyl-5-oxo-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-
CAS Number: 158392-74-6
Product Number: AG001Q59(AGN-PC-0Q7G5J)
Synonyms:
MDL No:
Molecular Formula: C13H21NO5
Molecular Weight: 271.3095

Identification/Properties


Computed Properties
Molecular Weight:
271.313g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
271.142g/mol
Monoisotopic Mass:
271.142g/mol
Topological Polar Surface Area:
72.9A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
408
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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