Phenylalanine, phenylmethyl ester, hydrochloride


Chemical Name: Phenylalanine, phenylmethyl ester, hydrochloride
CAS Number: 2462-32-0
Product Number: AG002OTA(AGN-PC-0O87HN)
Synonyms:
MDL No:
Molecular Formula: C16H18ClNO2
Molecular Weight: 291.7726

Identification/Properties


Properties
MP:
197-200 °C
BP:
382.8°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
-12 ° (C=1, 80% acetic acid)
Computed Properties
Molecular Weight:
291.775g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
291.103g/mol
Monoisotopic Mass:
291.103g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
268
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:
2
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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