2,4,6-TRIBROMOANISOLE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H5Br3O
Molecular Weight	344.826
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(Br)C=C(Br)C=C1Br

InChI

InChIKey=YXTRCOAFNXQTKL-UHFFFAOYSA-N

InChI=1S/C7H5Br3O/c1-11-7-5(9)2-4(8)3-6(7)10/h2-3H,1H3

HIDE SMILES / InChI

Molecular Formula	C7H5Br3O
Molecular Weight	344.826
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Accurate determination of 2,4,6-trichloroanisole in wines at low parts per trillion by solid-phase microextraction followed by GC-ECD.	2003 Jun 4	12769515
Identification and responsibility of 2,4,6-tribromoanisole in musty, corked odors in wine.	2004 Mar 10	14995130
Analysis of anisoles in wines using pervaporation coupled to gas chromatography-mass spectrometry.	2004 Sep 17	15499927
Inhibition and induction of aromatase (CYP19) activity by brominated flame retardants in H295R human adrenocortical carcinoma cells.	2005 Dec	16177243
Simultaneous picogram determination of "earthy-musty" odorous compounds in water using solid-phase microextraction and gas chromatography-mass spectrometry coupled with initial cool programmable temperature vaporizer inlet.	2005 Dec 9	16314155
Biological activity and physicochemical parameters of marine halogenated natural products 2,3,3',4,4',5,5'-heptachloro-1'-methyl-1,2'-bipyrrole and 2,4,6-tribromoanisole.	2005 Jan	15657799
Brominated flame retardants and other organobromines in Norwegian predatory bird eggs.	2005 Oct	16182862
Highly selective solid-phase extraction and large volume injection for the robust gas chromatography-mass spectrometric analysis of TCA and TBA in wines.	2005 Sep 30	16130792
Determination of 2,4,6-trichloroanisole and 2,4,6-tribromoanisole on ng L-1 to pgL-1 levels in wine by solid-phase microextraction and gas chromatography-high-resolution mass spectrometry.	2006 Apr 7	16464462
Routine analysis of off-flavor compounds in water at sub-part-per-trillion level by large-volume injection GC/MS with programmable temperature vaporizing inlet.	2006 Feb	16458343
Non-destructive method to determine halophenols and haloanisoles in cork stoppers by headspace sorptive extraction.	2006 May 12	16516907
Determination of haloanisols in white wine by immunosorbent solid-phase extraction followed by enzyme-linked immunosorbent assay.	2006 Nov 29	17117807
Rapid headspace solid-phase microextraction/gas chromatographic/mass spectrometric assay for the quantitative determination of some of the main odorants causing off-flavours in wine.	2007 Feb 2	17188281
Multiple headspace solid-phase microextraction for eliminating matrix effect in the simultaneous determination of haloanisoles and volatile phenols in wines.	2007 Sep 28	17727868
Anthropogenic and naturally occurring organobrominated compounds in two deep-sea fish species from the Mediterranean Sea.	2008 Dec 1	19192777
Persistent organohalogen contaminant burdens in Antarctic krill (Euphausia superba) from the eastern Antarctic sector: a baseline study.	2008 Dec 15	18848720
Determination of 2,4,6-trichloroanisole and 2,4,6-tribromoanisole in wine using microextraction in packed syringe and gas chromatography-mass spectrometry.	2008 Jul 9	18529064
Comparison of stir bar sorptive extraction and solid-phase microextraction to determine halophenols and haloanisoles by gas chromatography-ion trap tandem mass spectrometry.	2008 May 15	18585142
Application of robust NiTi-ZrO2-PEG SPME fiber in the determination of haloanisoles in cork stopper samples.	2008 Nov 23	18940325
Comparison of two SPME fibers for the extraction of some off-flavor cork-taint compounds in bottled wines investigated by GC-HRMS.	2009 Apr	19190895
Determination of halogenated natural products in passive samplers deployed along the Great Barrier Reef, Queensland/Australia.	2009 Aug 15	19746703
Expression and functional characterization of choline transporter in human keratinocytes.	2009 Jan	19122366
Methods for the determination of phenolic brominated flame retardants, and by-products, formulation intermediates and decomposition products of brominated flame retardants in water.	2009 Jan 16	18762297
Uptake and biotransformation of structurally diverse brominated flame retardants in zebrafish (Danio rerio) after dietary exposure.	2009 May	19049262
Anthropogenic and naturally-produced organobrominated compounds in bluefin tuna from the Mediterranean Sea.	2009 Sep	19651427
Neutral and phenolic brominated organic compounds of natural and anthropogenic origin in northeast Atlantic Greenland shark (Somniosus microcephalus).	2010 Dec	20891018
Optimisation of a dispersive liquid-liquid microextraction method for the simultaneous determination of halophenols and haloanisoles in wines.	2010 Dec 3	21035812
Oral exposure of adult zebrafish (Danio rerio) to 2,4,6-tribromophenol affects reproduction.	2010 Oct 1	20719397

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:41:58 GMT 2023` Edited by `admin` on `Fri Dec 15 18:41:58 GMT 2023`
Record UNII	DO7M3M4LX5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4,6-TRIBROMOANISOLE

Systematic Name

English

2,4,6-TRIBROMOANISOLE [MI]

Common Name

English

NSC-2218

Code

English

TRIBROMOANISOLE

Systematic Name

English

2,4,6-TRIBROMOANISOLE [HSDB]

Common Name

English

1,3,5-TRIBROMO-2-METHOXYBENZENE

Systematic Name

English

BENZENE, 1,3,5-TRIBROMO-2-METHOXY-

Systematic Name

English

METHYL 2,4,6-TRIBROMOPHENYL ETHER

Systematic Name

English

ANISOLE, 2,4,6-TRIBROMO-

Systematic Name

English

Code System Code Type Description

WIKIPEDIA

2,4,6-TRIBROMOANISOLE