PENTABROMOPHENOL

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6HBr5O
Molecular Weight	488.592
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=C(Br)C(Br)=C(Br)C(Br)=C1Br

InChI

InChIKey=SVHOVVJFOWGYJO-UHFFFAOYSA-N

InChI=1S/C6HBr5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H

HIDE SMILES / InChI

Molecular Formula	C6HBr5O
Molecular Weight	488.592
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
Identification and quantification of products formed via photolysis of decabromodiphenyl ether.	2009-05	19360447
2,3,4,5,6-Penta-bromo-phenol.	2008-09-13	21201129
Electron impact and electron capture negative ionization mass spectra of polybrominated diphenyl ethers and methoxylated polybrominated diphenyl ethers.	2008-04-01	18504949
Molecular characterization of brominated persistent pollutants using extended X-ray absorption fine structure (EXAFS) spectroscopy.	2008-02	17999054
Effects of brominated flame retardants and brominated dioxins on steroidogenesis in H295R human adrenocortical carcinoma cell line.	2007-04	17447562
Automated solid-phase extraction for the determination of polybrominated diphenyl ethers and polychlorinated biphenyls in serum--application on archived Norwegian samples from 1977 to 2003.	2007-02-01	17023223
Development of a solid-phase microextraction method for the analysis of phenolic flame retardants in water samples.	2006-08-18	16600262
Water solubility and partitioning behavior of brominated phenols.	2004-06	15376523
Brominated flame retardants and phenolic endocrine disrupters in Finnish human adipose tissue.	2003-12	14512116
Ozonolysis of phenols in aqueous solution.	2003-05-21	12926365
Vibrational analysis of substituted phenols: part I. Vibrational spectra, normal coordinate analysis and transferability of force constants of some formyl-, methoxy-, formylmethoxy-, methyl- and halogeno-phenols.	2002-12	12511089
A new method for determination of halogenated flame retardants in human milk using solid-phase extraction.	2002-04	11991528
Determination of phenolic flame-retardants in human plasma using solid-phase extraction and gas chromatography-electron-capture mass spectrometry.	2001-01-05	11204209
Potent competitive interactions of some brominated flame retardants and related compounds with human transthyretin in vitro.	2000-07	10869457

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:00:05 GMT 2025` Edited by `admin` on `Mon Mar 31 19:00:05 GMT 2025`
Record UNII	V89A88NMMX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTABROMOPHENOL

Systematic Name

English

NSC-5717

Preferred Name

English

PHENOL, 2,3,4,5,6-PENTABROMO-

Systematic Name

English

2,3,4,5,6-PENTABROMOPHENOL

Systematic Name

English

PENTABROMOPHENOL [HSDB]

Common Name

English

PERBROMOPHENOL

Systematic Name

English

BROMOPHENASIC ACID

Common Name

English

Code System Code Type Description

HSDB

5500