1,4-Piperidinedicarboxylic acid, 4-methyl 1-(phenylmethyl) ester


Chemical Name: 1,4-Piperidinedicarboxylic acid, 4-methyl 1-(phenylmethyl) ester
CAS Number: 138163-07-2
Product Number: AG00183I(AGN-PC-0K69CR)
Synonyms:
MDL No: MFCD06203777
Molecular Formula: C15H19NO4
Molecular Weight: 277.3157

Identification/Properties


Computed Properties
Molecular Weight:
277.32g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
277.131g/mol
Monoisotopic Mass:
277.131g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
331
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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