Benzoic acid, 4-[[(1,1-dimethylethoxy)carbonyl]methylamino]-


Chemical Name: Benzoic acid, 4-[[(1,1-dimethylethoxy)carbonyl]methylamino]-
CAS Number: 263021-30-3
Product Number: AG002SN2(AGN-PC-03DZ9G)
Synonyms:
MDL No:
Molecular Formula: C13H17NO4
Molecular Weight: 251.2784

Identification/Properties


Properties
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
251.282g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
251.116g/mol
Monoisotopic Mass:
251.116g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
313
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:
H317-H412
Precautionary Statements:
P273-P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



Benzoic acid, 4-[(1,1-dimethylethoxy)carbonyl]methylamino] is a versatile compound widely used in chemical synthesis. It serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and specialty chemicals. With its unique structure, this compound enables the introduction of specific functional groups into organic molecules, facilitating the synthesis of complex organic compounds. In addition, its controlled release properties make it an ideal intermediate in the development of controlled drug delivery systems. Its ability to form stable intermediates with reactive species further enhances its utility in a range of synthetic pathways.