Benzoic acid, 4-amino-, 1,1-dimethylethyl ester


Chemical Name: Benzoic acid, 4-amino-, 1,1-dimethylethyl ester
CAS Number: 18144-47-3
Product Number: AG0022WA(AGN-PC-0JOAON)
Synonyms:
MDL No: MFCD00665790
Molecular Formula: C11H15NO2
Molecular Weight: 193.2423

Identification/Properties


Properties
MP:
108-110 °C
BP:
322.4°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
193.246g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
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:
200
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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