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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)-

5-tert-butyl-1H-indole-3-carbaldehyde

O=Cc1c[nH]c2c1cc(cc2)C(C)(C)C Request for Quotation
Chemical Name: 5-tert-butyl-1H-indole-3-carbaldehyde
CAS Number: 1369055-82-2
Product Number: AG0012JC(AGN-PC-0WAM0T)
Synonyms:
MDL No:
Molecular Formula: C13H15NO
Molecular Weight: 201.2643

Identification/Properties

Computed Properties
Molecular Weight:
201.269g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
201.115g/mol
Monoisotopic Mass:
201.115g/mol
Topological Polar Surface Area:
32.9A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
243
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-tert-butyl-1H-indole-3-carbaldehyde is a versatile compound commonly utilized in chemical synthesis for its unique properties. Its application in organic chemistry is particularly notable in the field of medicinal chemistry and drug development. This compound serves as a valuable building block for the synthesis of various pharmaceutical agents, including potential anticancer and antimicrobial agents. With its distinct structure, 5-tert-butyl-1H-indole-3-carbaldehyde enables chemists to access a diverse range of functionalized molecules through strategic transformations, such as selective reduction, oxidation, and functional group manipulations. This compound's role in chemical synthesis extends to the creation of novel materials and complex organic molecules with tailored properties for various industrial applications.