Phenylalanine, N-acetyl-, methyl ester


Chemical Name: Phenylalanine, N-acetyl-, methyl ester
CAS Number: 3618-96-0
Product Number: AG00BZTC(AGN-PC-0O9BR1)
Synonyms:
MDL No:
Molecular Formula: C12H15NO3
Molecular Weight: 221.2524

Identification/Properties


Properties
BP:
391°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
221.256g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
221.105g/mol
Monoisotopic Mass:
221.105g/mol
Topological Polar Surface Area:
55.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
247
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:
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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