Morpholine, 4-(2-methyl-4-nitrophenyl)-


Chemical Name: Morpholine, 4-(2-methyl-4-nitrophenyl)-
CAS Number: 223404-63-5
Product Number: AG006YQZ(AGN-PC-0NAR9K)
Synonyms:
MDL No:
Molecular Formula: C11H14N2O3
Molecular Weight: 222.2405

Identification/Properties


Computed Properties
Molecular Weight:
222.244g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
222.1g/mol
Monoisotopic Mass:
222.1g/mol
Topological Polar Surface Area:
58.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
248
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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Chemical Structure



4-(2-Methyl-4-nitrophenyl)morpholine, also known as $name$, is a versatile compound that finds wide application in chemical synthesis. This compound is particularly valued for its role as a key intermediate in the production of various pharmaceuticals and agrochemicals. Its unique structure and properties make it a valuable building block for the synthesis of complex organic molecules, especially those that require the incorporation of a morpholine ring system.One of the primary uses of 4-(2-Methyl-4-nitrophenyl)morpholine is in the synthesis of novel drug candidates. The presence of both the nitro and morpholine functionalities in this compound allows for the facile introduction of diverse chemical groups, enabling the fine-tuning of pharmacological properties such as bioavailability, potency, and selectivity. Pharmaceutical researchers often utilize this compound as a starting material to access structurally diverse libraries of potential drug molecules through further modification and derivatization.In addition to its applications in drug discovery and development, 4-(2-Methyl-4-nitrophenyl)morpholine is also employed in the synthesis of agrochemicals. Its compatibility with various synthetic strategies allows for the efficient construction of pesticidal and herbicidal agents with improved efficacy and environmental safety profiles. By leveraging the unique reactivity and structural features of this compound, chemists can access a wide range of bioactive molecules that play a crucial role in modern agriculture.Overall, the significance of 4-(2-Methyl-4-nitrophenyl)morpholine in chemical synthesis lies in its versatility and utility as a key intermediate for the preparation of biologically active compounds. Whether in the realm of pharmaceuticals or agrochemicals, this compound serves as an indispensable tool for synthetic chemists seeking to explore new avenues in drug discovery and crop protection.