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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)-

2,3-Naphthalenedicarbonitrile, 5-amino-1,4-dihydro-1,4-dioxo-

N#CC1=C(C#N)C(=O)c2c(C1=O)c(N)ccc2 Request for Quotation
Chemical Name: 2,3-Naphthalenedicarbonitrile, 5-amino-1,4-dihydro-1,4-dioxo-
CAS Number: 68217-29-8
Product Number: AG003MD1(AGN-PC-0JTTA0)
Synonyms:
MDL No:
Molecular Formula: C12H5N3O2
Molecular Weight: 223.187

Identification/Properties

Properties
MP:
287℃ (dec.)
Form:
Solid
Computed Properties
Molecular Weight:
223.191g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
223.038g/mol
Monoisotopic Mass:
223.038g/mol
Topological Polar Surface Area:
108A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
528
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


5-Amino-1,4-dioxo-1,4-dihydronaphthalene-2,3-dicarbonitrile is a versatile compound commonly utilized in chemical synthesis. Its unique structure with multiple reactive sites makes it ideal for various transformations, providing a valuable building block for the preparation of complex molecules. In organic synthesis, this compound can serve as a key intermediate for the construction of heterocyclic compounds, pharmaceuticals, and functional materials. By incorporating 5-Amino-1,4-dioxo-1,4-dihydronaphthalene-2,3-dicarbonitrile into reactions, chemists can introduce amino and cyano groups into target molecules, allowing for the modification of their physicochemical properties. Moreover, the presence of multiple electron-rich and electron-deficient sites in this compound offers opportunities for diversification through various functionalization reactions such as nucleophilic addition, condensation, and cross-coupling reactions. This enables the synthesis of a wide range of organic compounds with tailored properties for various applications in medicinal chemistry, materials science, and agrochemicals.