L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 4-methyl ester


Chemical Name: L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 4-methyl ester
CAS Number: 3160-47-2
Product Number: AG003VDC(AGN-PC-0O8UKW)
Synonyms:
MDL No:
Molecular Formula: C13H15NO6
Molecular Weight: 281.2613

Identification/Properties


Properties
MP:
98℃
BP:
503.6°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
281.264g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
8
Exact Mass:
281.09g/mol
Monoisotopic Mass:
281.09g/mol
Topological Polar Surface Area:
102A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
351
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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