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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-Indole-7-carbonitrile,5-[(2R)-2-aminopropyl]-1-[3-(benzoyloxy)propyl]-2,3-dihydro-,(2R,3R)-2,3-dihydroxybutanedioate (1:1)

OC(=O)[C@@H]([C@H](C(=O)O)O)O.N#Cc1cc(C[C@H](N)C)cc2c1N(CCCOC(=O)c1ccccc1)CC2 Request for Quotation
Chemical Name: 1H-Indole-7-carbonitrile,5-[(2R)-2-aminopropyl]-1-[3-(benzoyloxy)propyl]-2,3-dihydro-,(2R,3R)-2,3-dihydroxybutanedioate (1:1)
CAS Number: 239463-85-5
Product Number: AG00346D(AGN-PC-0QZYNW)
Synonyms:
MDL No:
Molecular Formula: C26H31N3O8
Molecular Weight: 513.5396

Identification/Properties

Properties
MP:
> 180° C (dec.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
513.547g/mol
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
11
Rotatable Bond Count:
11
Exact Mass:
513.211g/mol
Monoisotopic Mass:
513.211g/mol
Topological Polar Surface Area:
194A^2
Heavy Atom Count:
37
Formal Charge:
0
Complexity:
671
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-[(2R)-2-aminopropyl]-1-[3-(benzoyloxy)propyl]-2,3-dihydro-1H-indole-7-carbonitrile(2R,3R)-2,3-dihydroxybutanendioate serves as a valuable reagent in chemical synthesis due to its versatile applications. This compound can act as a key intermediate in the production of various pharmaceuticals and organic compounds. Specifically, it can be utilized in the synthesis of complex molecules by serving as a building block for the introduction of specific functional groups or stereochemical elements. Its unique structure, incorporating both an amino group and a carboxylic acid group, enables it to participate in a range of chemical reactions including condensation, acylation, and substitution reactions. Additionally, the presence of the indole moiety confers aromatic characteristics that can influence the reactivity and selectivity of the compound in synthetic pathways. Overall, the strategic incorporation of 5-[(2R)-2-aminopropyl]-1-[3-(benzoyloxy)propyl]-2,3-dihydro-1H-indole-7-carbonitrile(2R,3R)-2,3-dihydroxybutanendioate in chemical synthesis offers researchers a powerful tool to access structurally diverse and biologically relevant compounds.