L-Phenylalanine, 2,4-dinitro-


Chemical Name: L-Phenylalanine, 2,4-dinitro-
CAS Number: 49607-21-8
Product Number: AG00DKJJ(AGN-PC-0OB0BV)
Synonyms:
MDL No: MFCD08061615
Molecular Formula: C9H9N3O6
Molecular Weight: 255.1843

Identification/Properties


Computed Properties
Molecular Weight:
255.186g/mol
XLogP3:
-1.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
255.049g/mol
Monoisotopic Mass:
255.049g/mol
Topological Polar Surface Area:
155A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
349
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

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NMR Spectrum


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