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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Isoxazole, 4,5-dihydro-3-nitro-

[O-][N+](=O)C1=NOCC1 Request for Quotation
Chemical Name: Isoxazole, 4,5-dihydro-3-nitro-
CAS Number: 1121-14-8
Product Number: AG0083F1(AGN-PC-0JMP58)
Synonyms:
MDL No:
Molecular Formula: C3H4N2O3
Molecular Weight: 116.0755

Identification/Properties

Computed Properties
Molecular Weight:
116.076g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
116.022g/mol
Monoisotopic Mass:
116.022g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
136
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-Nitro-4,5-dihydroisoxazole is a versatile compound widely utilized in chemical synthesis for the creation of various organic molecules. One key application of this compound is its use as a building block in the synthesis of pharmaceuticals and agrochemicals. Its nitro group provides a valuable handle for further derivatization, allowing chemists to introduce different functional groups and tailor the properties of the final product. Additionally, the dihydroisoxazole ring system present in this compound offers unique reactivity, making it a valuable intermediate in the construction of complex organic structures. Overall, 3-Nitro-4,5-dihydroisoxazole plays a crucial role in the development of new compounds with diverse applications in the field of chemistry.