2-amino-3-(4-bromophenyl)propanoic acid


Chemical Name: 2-amino-3-(4-bromophenyl)propanoic acid
CAS Number: 14091-15-7
Product Number: AG001D0D(AGN-PC-0JLVUO)
Synonyms:
MDL No: MFCD00002599
Molecular Formula: C9H10BrNO2
Molecular Weight: 244.0852

Identification/Properties


Properties
MP:
262-263 °C
BP:
368.406 °C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
1.6120 (estimate)
Computed Properties
Molecular Weight:
244.088g/mol
XLogP3:
-0.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
242.989g/mol
Monoisotopic Mass:
242.989g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
179
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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