Benzoic acid, 2-amino-3-methyl-


Chemical Name: Benzoic acid, 2-amino-3-methyl-
CAS Number: 4389-45-1
Product Number: AG003GDQ(AGN-PC-0JLR52)
Synonyms:
MDL No:
Molecular Formula: C8H9NO2
Molecular Weight: 151.1626

Identification/Properties


Properties
MP:
174-177 °C(lit.)
BP:
315.1°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5810 (estimate)
Computed Properties
Molecular Weight:
151.165g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
151.063g/mol
Monoisotopic Mass:
151.063g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
158
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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