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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)-

2H-Isoindole-2-butanal, 1,3-dihydro-1,3-dioxo-

O=CCCCN1C(=O)c2c(C1=O)cccc2 Request for Quotation
Chemical Name: 2H-Isoindole-2-butanal, 1,3-dihydro-1,3-dioxo-
CAS Number: 3598-60-5
Product Number: AG00CIUI(AGN-PC-08XVCJ)
Synonyms:
MDL No:
Molecular Formula: C12H11NO3
Molecular Weight: 217.2206

Identification/Properties

Computed Properties
Molecular Weight:
217.224g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
217.074g/mol
Monoisotopic Mass:
217.074g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
289
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


4-(1,3-Dioxoisoindolin-2-yl)butanal is a versatile compound widely used in chemical synthesis for its unique reactivity and structural features. This compound serves as a valuable building block in the synthesis of various complex organic molecules by undergoing a range of key synthetic transformations.One of the primary applications of 4-(1,3-Dioxoisoindolin-2-yl)butanal is as a key intermediate in the preparation of pharmaceutical compounds. Its functional groups and carbon skeleton make it a valuable precursor for the synthesis of bioactive molecules, including potential drug candidates. Through strategic modifications and derivatizations, chemists can access a diverse array of pharmacologically relevant structures.Additionally, 4-(1,3-Dioxoisoindolin-2-yl)butanal is utilized in the construction of heterocyclic compounds through cyclization reactions. Its incorporation into ring-forming reactions allows for the efficient synthesis of complex organic frameworks with diverse substitution patterns. These heterocyclic compounds have widespread applications in medicinal chemistry, materials science, and agrochemical research.Furthermore, the reactivity of 4-(1,3-Dioxoisoindolin-2-yl)butanal enables it to participate in various transformations such as nucleophilic additions, condensations, and functional group manipulations. These synthetic pathways enable the rapid construction of molecular scaffolds with tailored functionalities, making this compound a valuable tool for organic chemists seeking to access structurally intricate compounds.Overall, 4-(1,3-Dioxoisoindolin-2-yl)butanal plays a crucial role in organic synthesis as a versatile and valuable building block for the development of diverse chemical compounds with applications spanning the fields of pharmaceuticals, materials science, and beyond.