1-Piperidinecarboxylic acid, 4-oxo-, ethyl ester


Chemical Name: 1-Piperidinecarboxylic acid, 4-oxo-, ethyl ester
CAS Number: 29976-53-2
Product Number: AG0035DC(AGN-PC-0JKNYP)
Synonyms:
MDL No: MFCD00006188
Molecular Formula: C8H13NO3
Molecular Weight: 171.1937

Identification/Properties


Properties
BP:
273.4°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.475(lit.)
Computed Properties
Molecular Weight:
171.196g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
171.09g/mol
Monoisotopic Mass:
171.09g/mol
Topological Polar Surface Area:
46.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
181
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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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