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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-Indol-3-ol, 5-bromo-, acetate (ester)

CC(=O)Oc1c[nH]c2c1cc(Br)cc2 Request for Quotation
Chemical Name: 1H-Indol-3-ol, 5-bromo-, acetate (ester)
CAS Number: 17357-14-1
Product Number: AG001Z1U(AGN-PC-0QACD0)
Synonyms:
MDL No:
Molecular Formula: C10H8BrNO2
Molecular Weight: 254.0800

Identification/Properties

Computed Properties
Molecular Weight:
254.083g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
252.974g/mol
Monoisotopic Mass:
252.974g/mol
Topological Polar Surface Area:
42.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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#:
N/A
Hazard Statements:
H302-H317
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Bromo-1H-indol-3-yl acetate serves as a versatile building block in chemical synthesis due to its unique structural and reactivity characteristics. This compound is commonly employed in the preparation of diverse organic molecules, pharmaceuticals, and materials through various synthetic pathways. Its bromine functional group enables selective transformations, facilitating the introduction of specific substituents or motifs into target molecules. Additionally, the reactive indole ring moiety offers a site for further derivatization, expanding its utility in the construction of complex structures. In particular, 5-Bromo-1H-indol-3-yl acetate finds widespread use in the synthesis of biologically active compounds, natural products, and advanced materials, highlighting its significance in modern organic chemistry research and industrial applications.