L-Phenylalanine, 4-nitro-, monohydrate


Chemical Name: L-Phenylalanine, 4-nitro-, monohydrate
CAS Number: 207591-86-4
Product Number: AG002J57(AGN-PC-0O7NNH)
Synonyms:
MDL No: MFCD00150543
Molecular Formula: C9H12N2O5
Molecular Weight: 228.2020

Identification/Properties


Properties
MP:
245-251 °C (dec.)(lit.)
BP:
414.1°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
228.204g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
228.075g/mol
Monoisotopic Mass:
228.075g/mol
Topological Polar Surface Area:
110A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
243
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


NMR Spectrum


Other Analytical Data


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