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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)-

1H-Isoindole-1,3(2H)-dione, 5-nitro-

O=C1NC(=O)c2c1cc(cc2)[N+](=O)[O-] Request for Quotation
Chemical Name: 1H-Isoindole-1,3(2H)-dione, 5-nitro-
CAS Number: 89-40-7
Product Number: AG003LWI(AGN-PC-0JK7UH)
Synonyms:
MDL No:
Molecular Formula: C8H4N2O4
Molecular Weight: 192.1284

Identification/Properties

Properties
MP:
206 °C
BP:
328.09°C (rough estimate)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4900 (estimate)
Computed Properties
Molecular Weight:
192.13g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
192.017g/mol
Monoisotopic Mass:
192.017g/mol
Topological Polar Surface Area:
92A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
309
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Nitroisoindoline-1,3-dione is a versatile compound that finds application in various chemical synthesis processes. As a precursor in organic chemistry, it serves as a key building block in the creation of complex molecules through multi-step synthesis routes. This compound's unique structure and functional groups enable it to participate in a range of reactions, such as reductions, cyclizations, and functional group modifications. In particular, 5-Nitroisoindoline-1,3-dione is valued for its ability to introduce specific functionalities into target molecules efficiently and with high selectivity. In the synthesis of pharmaceuticals, agrochemicals, and advanced materials, this compound plays a crucial role in the construction of molecular frameworks with desired properties. Additionally, its reactivity and compatibility with various reaction conditions make it a valuable tool for organic chemists aiming to design and develop novel compounds with specific applications.