4-Pentenoic acid, 2-[[(phenylmethoxy)carbonyl]amino]-, (2R)-


Chemical Name: 4-Pentenoic acid, 2-[[(phenylmethoxy)carbonyl]amino]-, (2R)-
CAS Number: 127474-54-8
Product Number: AG000X4C(AGN-PC-0O0TS4)
Synonyms:
MDL No:
Molecular Formula: C13H15NO4
Molecular Weight: 249.2625

Identification/Properties


Computed Properties
Molecular Weight:
249.266g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
7
Exact Mass:
249.1g/mol
Monoisotopic Mass:
249.1g/mol
Topological Polar Surface Area:
75.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
297
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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