2-cyclopropyl-1,3-benzoxazol-5-amine


Chemical Name: 2-cyclopropyl-1,3-benzoxazol-5-amine
CAS Number: 1017027-77-8
Product Number: AG00058Q(AGN-PC-04PQCG)
Synonyms:
MDL No:
Molecular Formula: C10H10N2O
Molecular Weight: 174.1992

Identification/Properties


Computed Properties
Molecular Weight:
174.203g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
174.079g/mol
Monoisotopic Mass:
174.079g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
205
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Cyclopropylbenzo[d]oxazol-5-amine, also known as $name$, is a versatile compound that finds wide application in chemical synthesis, particularly in the pharmaceutical and agrochemical industries. This compound serves as a valuable building block in the creation of various biologically active molecules due to its unique structural properties.In chemical synthesis, 2-Cyclopropylbenzo[d]oxazol-5-amine acts as a key intermediate in the production of heterocyclic compounds and medicinal substances. Its cyclopropyl and oxazolamine groups provide opportunities for diverse chemical transformations, allowing for the synthesis of novel compounds with potential pharmaceutical benefits. The presence of the oxazol ring in the molecule confers different reactivity patterns, enabling the introduction of specific functional groups at precise positions during synthetic processes.Furthermore, the cyclopropyl ring in 2-Cyclopropylbenzo[d]oxazol-5-amine imparts steric effects that can influence the stereochemistry and biological activity of the final products. This is particularly important in drug design, where the three-dimensional arrangement of atoms in a molecule can significantly impact its interactions with biological targets.Overall, 2-Cyclopropylbenzo[d]oxazol-5-amine serves as a valuable tool in chemical synthesis, offering chemists the ability to access a wide range of structurally diverse and pharmacologically relevant compounds through strategic manipulations and derivatizations.