1,2-Piperidinedicarboxylic acid, 1-(1,1-dimethylethyl) 2-ethyl ester


Chemical Name: 1,2-Piperidinedicarboxylic acid, 1-(1,1-dimethylethyl) 2-ethyl ester
CAS Number: 362703-48-8
Product Number: AG007A7O(AGN-PC-0K69EQ)
Synonyms:
MDL No: MFCD03788452
Molecular Formula: C13H23NO4
Molecular Weight: 257.3260

Identification/Properties


Computed Properties
Molecular Weight:
257.33g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
257.163g/mol
Monoisotopic Mass:
257.163g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
309
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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