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> Main
CHEBI:90149 - 5-bromo-4-chloro-3-indolyl acetate
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ChEBI Name
5-bromo-4-chloro-3-indolyl acetate
ChEBI ID
CHEBI:90149
Definition
An acetate ester obtained by formal condensation of the carboxy group of acetic acid with the hydroxy group of 5-bromo-4-chloroindoxyl.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C10H7BrClNO2
Net Charge
0
Average Mass
288.525
Monoisotopic Mass
286.93487
InChI
InChI=1S/C10H7BrClNO2/c1-5(14)15-8-4-13-7-3-2-6(11)10(12)9(7)8/h2-4,13H,1H3
InChIKey
WPWLFFMSSOAORQ-UHFFFAOYSA-N
SMILES
N1C=C(C2=C1C=CC(=C2Cl)Br)OC(=O)C
Roles Classification
Application
(s):
chromogenic compound
Colourless, endogenous or exogenous pigment precursors that may be transformed by biological mechanisms into coloured compounds. They are used in biochemical assays and in diagnosis as indicators, particularly in the form of enzyme substrates.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
5-bromo-4-chloro-3-indolyl acetate (
CHEBI:90149
)
has functional parent
indoxyl (
CHEBI:17840
)
5-bromo-4-chloro-3-indolyl acetate (
CHEBI:90149
)
has role
chromogenic compound (
CHEBI:75050
)
5-bromo-4-chloro-3-indolyl acetate (
CHEBI:90149
)
is a
acetate ester (
CHEBI:47622
)
5-bromo-4-chloro-3-indolyl acetate (
CHEBI:90149
)
is a
bromoindole (
CHEBI:52514
)
5-bromo-4-chloro-3-indolyl acetate (
CHEBI:90149
)
is a
chloroindole (
CHEBI:52508
)
IUPAC Name
5-bromo-4-chloro-1
H
-indol-3-yl acetate
Synonyms
Sources
5-Bromo-4-chloroindoxyl acetate
ChemIDplus
acetic acid-(5-bromo-4-chloro-indol-3-yl ester)
ChEBI
BCDA
ChemIDplus
Registry Numbers
Types
Sources
199004
Reaxys Registry Number
Reaxys
3252-36-6
CAS Registry Number
ChemIDplus
Last Modified
29 October 2015