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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-1-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester

OCc1cn(c2c1cccc2)C(=O)OC(C)(C)C Request for Quotation
Chemical Name: 1H-Indole-1-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester
CAS Number: 96551-22-3
Product Number: AG003ST1(AGN-PC-0NFH7Y)
Synonyms:
MDL No: MFCD05864717
Molecular Formula: C14H17NO3
Molecular Weight: 247.2897

Identification/Properties

Properties
BP:
396°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
247.294g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
247.121g/mol
Monoisotopic Mass:
247.121g/mol
Topological Polar Surface Area:
51.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
311
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


1-Boc-3-Hydroxymethylindole is a versatile compound that finds valuable application in chemical synthesis. Known for its unique structure and properties, this compound serves as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and functional materials. With its Boc (tert-butoxycarbonyl) protecting group, 1-Boc-3-Hydroxymethylindole enables selective functionalization at specific positions, facilitating the creation of intricate molecular architectures. Its presence in synthetic pathways allows chemists to control regioselectivity and stereoselectivity, leading to the production of complex molecules with high efficiency. Furthermore, the hydroxymethyl group on the indole ring offers synthetic flexibility by serving as a handle for further elaboration through various chemical transformations. Overall, the strategic utilization of 1-Boc-3-Hydroxymethylindole in chemical synthesis enables the construction of diverse and structurally intricate compounds with potential applications in drug discovery and material science.