1,2-Piperidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) ester


Chemical Name: 1,2-Piperidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) ester
CAS Number: 661458-35-1
Product Number: AG003A6E(AGN-PC-0948Q1)
Synonyms:
MDL No:
Molecular Formula: C11H17NO5
Molecular Weight: 243.2564

Identification/Properties


Computed Properties
Molecular Weight:
243.259g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
243.111g/mol
Monoisotopic Mass:
243.111g/mol
Topological Polar Surface Area:
83.9A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
344
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
H302-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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