Benzenebutanoic acid, a-amino-, (aR)-


Chemical Name: Benzenebutanoic acid, a-amino-, (aR)-
CAS Number: 82795-51-5
Product Number: AG0032AO(AGN-PC-0UN9BV)
Synonyms:
MDL No: MFCD00063091
Molecular Formula: C10H13NO2
Molecular Weight: 179.2157

Identification/Properties


Properties
MP:
300 °C
BP:
324.8 °C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
-45 ° (C=1, 3mol/L HCl)
Computed Properties
Molecular Weight:
179.219g/mol
XLogP3:
-1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
179.095g/mol
Monoisotopic Mass:
179.095g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
164
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


NMR Spectrum


Other Analytical Data


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