3-(3-CHLORO-PHENYL)-ISOXAZOL-5-YLAMINE


Chemical Name: 3-(3-CHLORO-PHENYL)-ISOXAZOL-5-YLAMINE
CAS Number: 86685-95-2
Product Number: AG004KLF(AGN-PC-0KTGCY)
Synonyms:
MDL No: MFCD07383023
Molecular Formula: C9H7ClN2O
Molecular Weight: 194.6177

Identification/Properties


Properties
MP:
107-109 °C
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
194.618g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
194.025g/mol
Monoisotopic Mass:
194.025g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
179
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

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NMR Spectrum


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Chemical Structure



3-(3-Chlorophenyl)isoxazol-5-amine is a versatile compound that finds application in chemical synthesis as a key building block for the creation of various functional molecules. Due to its unique structure and reactivity, this compound serves as an essential intermediate in the production of pharmaceuticals, agrochemicals, and advanced materials. In chemical synthesis, 3-(3-Chlorophenyl)isoxazol-5-amine is commonly used for the development of novel organic compounds with diverse properties and applications. Its incorporation into complex molecular structures allows for the modification of physicochemical properties, enabling the design and synthesis of compounds with specific biological activities or material characteristics. With its utility in the field of chemical synthesis, this compound plays a crucial role in the discovery and development of new molecules with potential applications in various industries.