4-ETHYLPHENOL

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H10O
Molecular Weight	122.1644
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC1=CC=C(O)C=C1

InChI

InChIKey=HXDOZKJGKXYMEW-UHFFFAOYSA-N

InChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula	C8H10O
Molecular Weight	122.1644
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
Characterization of urinary volatiles in Swiss male mice (Mus musculus): bioassay of identified compounds.	2002 Dec	12571373
Determination of 4-ethylguaiacol and 4-ethylphenol in red wines using headspace-solid-phase microextraction-gas chromatography.	2002 Nov 1	12456088
Seasonal variation in microbial communities and organic malodor indicator compound concentrations in various types of swine manure storage systems.	2002 Nov-Dec	12469859
Treatment of phenolic wastewater using agricultural wastes as an adsorbent in a sequencing batch reactor.	2003	12862215
Glucuronidation and excretion of nonylphenol in perfused rat liver.	2003 Aug	12867487
Extraction and formation dynamic of oak-related volatile compounds from different volume barrels to wine and their behavior during bottle storage.	2003 Aug 27	12926895
Solubilization of phenols in surfactant/polyelectrolyte systems.	2003 Dec 1	14611773
Volatile compounds in a spanish red wine aged in barrels made of Spanish, French, and American oak wood.	2003 Dec 17	14664527
Quantitative structure-activity relationships for estrogen receptor binding affinity of phenolic chemicals.	2003 Mar	12598185
Synthesis and characterization of model compounds of the lysine tyrosyl quinone cofactor of lysyl oxidase.	2003 May 21	12785842
Isoflavones in several clover species and in milk from goats fed clovers.	2004	15630289
A novel class of achiral seco-analogs of CC-1065 and the duocarmycins: design, synthesis, DNA binding, and anticancer properties.	2004 Dec 1	15519165
Phenolic compounds in olive oils intended for refining: formation of 4-ethylphenol during olive paste storage.	2004 Dec 29	15612814
Metabolic activation of carcinogenic ethylbenzene leads to oxidative DNA damage.	2004 Dec 7	15560893
Profiling of sulfoconjugates in urine by using precursor ion and neutral loss scans in tandem mass spectrometry. Application to the investigation of heavy metal toxicity in rats.	2004 Jun	15236304
Mass-analyzed threshold ionization spectroscopy of p-methylphenol and p-ethylphenol cations and the alkyl substitution effect.	2004 Jun 8	15268078
Systematics of the anamorphic basidiomycetous yeast genus Trichosporon Behrend with the description of five novel species: Trichosporon vadense, T. smithiae, T. dehoogii, T. scarabaeorum and T. gamsii.	2004 May	15143052
Structural evolution in cationic micelles upon incorporation of a polar organic dopant.	2004 Nov 9	15518477
A simple cultural method for the presumptive detection of the yeasts Brettanomyces/Dekkera in wines.	2005	16305678
Evaluation of sample recovery of malodorous livestock gases from air sampling bags, solid-phase microextraction fibers, Tenax TA sorbent tubes, and sampling canisters.	2005 Aug	16187584
Bioregeneration of powdered activated carbon in the treatment of alkyl-substituted phenolic compounds in simultaneous adsorption and biodegradation processes.	2005 Jan	15620732
Distribution of conjugates of alkylphenols in milk from different ruminant species.	2005 Jan	15591361
Roles of hydrophobic interaction in a volume phase transition of alkylacrylamide gel induced by the hydrogen-bond-driving alkylphenol binding.	2005 Jan 20	16866479
3-Ethyl-2,7-dimethyl octane, a testosterone dependent unique urinary sex pheromone in male mouse (Mus musculus).	2005 Jun	15885448
Soybean-derived phytoestrogens regulate prostaglandin secretion in endometrium during cattle estrous cycle and early pregnancy.	2005 Mar	15734722
Phytoestrogens modulate prostaglandin production in bovine endometrium: cell type specificity and intracellular mechanisms.	2005 May	15855299
Phyto- and endogenous estrogens differently activate intracellular calcium ion mobilization in bovine endometrial cells.	2006 Dec	16963825
Variation in, and causes of, toxicity of cigarette butts to a cladoceran and microtox.	2006 Feb	16328625
Phytoestrogens and their metabolites inhibit the sensitivity of the bovine corpus luteum to luteotropic factors.	2006 Feb	16276041
Molecular typing of the yeast species Dekkera bruxellensis and Pichia guilliermondii recovered from wine related sources.	2006 Jan 15	16229917
Reduction of malodorous compounds from a treated swine anaerobic lagoon.	2006 Jan-Feb	16391290
An accurate and reproducible method for the quantitative analysis of isoflavones and their metabolites in rat plasma using liquid chromatography/mass spectrometry combined with photodiode array detection.	2006 Jul-Aug	16915859
Expression profiling of estrogen-responsive genes in breast cancer cells treated with alkylphenols, chlorinated phenols, parabens, or bis- and benzoylphenols for evaluation of estrogenic activity.	2006 May 25	16280211
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006 Nov	16497524
Bias of Tedlar bags in the measurement of agricultural odorants.	2006 Sep-Oct	16899738
Antithrombotic and antiatherosclerotic properties of olive oil and olive pomace polar extracts in rabbits.	2007	18253466
Fragmentation study on the phenolic alkaloid neferine and its analogues with anti-HIV activities by electrospray ionization tandem mass spectrometry with hydrogen/deuterium exchange and its application for rapid identification of in vitro microsomal metabolites of neferine.	2007	17546644
Determination of ethylphenols in wine by in situ derivatisation and headspace solid-phase microextraction-gas chromatography-mass spectrometry.	2007 Apr	17225107
Smoke-derived taint in wine: effect of postharvest smoke exposure of grapes on the chemical composition and sensory characteristics of wine.	2007 Dec 26	18052239
Determination of volatile phenols in red wines by dispersive liquid-liquid microextraction and gas chromatography-mass spectrometry detection.	2007 Jul 20	17517420
[Identification of volatile organic compounds in the manures of cow, hog and chicken by solid phase microextraction coupled with gas chromatography/mass spectrometry].	2007 May	17679445
4-ethylphenol and 4-ethylguaiacol in wines: estimating non-microbial sourced contributions and toxicological considerations.	2007 Nov	17978957
Detection and structural characterization of glutathione-trapped reactive metabolites using liquid chromatography-high-resolution mass spectrometry and mass defect filtering.	2007 Nov 1	17918967
Dekkera and Brettanomyces growth and utilisation of hydroxycinnamic acids in synthetic media.	2008 Apr	18322682
Effects of yeast cell-wall characteristics on 4-ethylphenol sorption capacity in model wine.	2008 Dec 24	19053375
Direct evidence revealing structural elements essential for the high binding ability of bisphenol A to human estrogen-related receptor-gamma.	2008 Jan	18197296
Comparison of metal oxide-based electronic nose and mass spectrometry-based electronic nose for the prediction of red wine spoilage.	2008 May 14	18412363
Receptor binding and transactivation activities of red clover isoflavones and their metabolites.	2008 Nov	18809497
Sex- and gonad-affecting scent compounds and 3 male pheromones in the rat.	2008 Sep	18515819
Changes in chemical composition of a red wine aged in acacia, cherry, chestnut, mulberry, and oak wood barrels.	2009 Mar 11	19196157

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:16:08 GMT 2023` Edited by `admin` on `Fri Dec 15 17:16:08 GMT 2023`
Record UNII	AGG7E6G0ZC
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-ETHYLPHENOL

Systematic Name

English

4-ETHYLPHENOL [HSDB]

Common Name

English

NSC-62012

Code

English

P-ETHYLPHENOL [FHFI]

Common Name

English

P-ETHYLPHENOL [EP IMPURITY]

Common Name

English

1-ETHYL-4-HYDROXYBENZENE

Systematic Name

English

FEMA NO. 3156

Code

English

P-HYDROXYETHYLBENZENE

Common Name

English

PHENOL, P-ETHYL-

Common Name

English

4-ETILFENOL

Common Name

English

PARA-ETHYLPHENOL

Systematic Name

English

METACRESOL IMPURITY K [EP IMPURITY]

Common Name

English

(P-HYDROXYPHENYL)ETHANE

Common Name

English

(4-HYDROXYPHENYL)ETHANE

Systematic Name

English

PHENOL, 4-ETHYL-

Systematic Name

English

Classification Tree Code System Code

JECFA EVALUATION

P-ETHYLPHENOL