Benzoic acid, 4-amino-, butyl ester


Chemical Name: Benzoic acid, 4-amino-, butyl ester
CAS Number: 94-25-7
Product Number: AG003KQY(AGN-PC-0JK69I)
Synonyms:
MDL No:
Molecular Formula: C11H15NO2
Molecular Weight: 193.2423

Identification/Properties


Properties
MP:
57-58 °C(lit.)
BP:
325.7 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Stability:
Light Sensitive
Refractive Index:
1.5480 (estimate)
Computed Properties
Molecular Weight:
193.246g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
193.11g/mol
Monoisotopic Mass:
193.11g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
174
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:
H315-H317-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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