2-Piperidinecarboxylic acid, 1-methyl-, ethyl ester


Chemical Name: 2-Piperidinecarboxylic acid, 1-methyl-, ethyl ester
CAS Number: 30727-18-5
Product Number: AG007JOT(AGN-PC-0JT067)
Synonyms:
MDL No:
Molecular Formula: C9H17NO2
Molecular Weight: 171.2368

Identification/Properties


Computed Properties
Molecular Weight:
171.24g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
171.126g/mol
Monoisotopic Mass:
171.126g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
159
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

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NMR Spectrum


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