Carbamic acid, [2-(4-hydroxyphenyl)ethyl]-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, [2-(4-hydroxyphenyl)ethyl]-, 1,1-dimethylethyl ester
CAS Number: 64318-28-1
Product Number: AG003SU9(AGN-PC-00CKQL)
Synonyms:
MDL No:
Molecular Formula: C13H19NO3
Molecular Weight: 237.2949

Identification/Properties


Properties
MP:
71-75 °C
BP:
395.704 °C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
237.299g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
237.136g/mol
Monoisotopic Mass:
237.136g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
240
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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Chemical Structure



This compound, Carbamic acid, N-[2-(4-hydroxyphenyl)ethyl]-, 1,1-dimethylethyl ester, plays a crucial role in chemical synthesis as a versatile building block for the development of pharmaceuticals, agrochemicals, and functional materials. Its unique structure and reactivity enable the efficient formation of complex molecular structures through various synthetic routes.In chemical synthesis, this compound is utilized as a key intermediate in the preparation of novel drug candidates with potential therapeutic benefits. By incorporating Carbamic acid, N-[2-(4-hydroxyphenyl)ethyl]-, 1,1-dimethylethyl ester into the molecular framework, chemists can introduce specific functional groups and fine-tune the physicochemical properties of the final compound. This enables the synthesis of structurally diverse molecules with enhanced biological activity and improved pharmacokinetic profiles.Furthermore, this compound serves as a valuable building block for the synthesis of bioactive compounds with antioxidant, anti-inflammatory, or antimicrobial properties. Its strategic placement within the molecular structure allows for the precise modification of biological activity, leading to the development of potent pharmaceutical agents or crop protection chemicals.Overall, the application of Carbamic acid, N-[2-(4-hydroxyphenyl)ethyl]-, 1,1-dimethylethyl ester in chemical synthesis offers a versatile and efficient pathway for the construction of novel compounds with diverse functionalities and potential applications in the fields of medicine, agriculture, and materials science.