EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

guaiacyl acetone
vanillyl methyl ketone

Supplier Sponsors

Name:1-(4-hydroxy-3-methoxyphenyl)propan-2-one
CAS Number: 2503-46-0Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:219-704-6
FDA UNII: 0626DKI6FE
Nikkaji Web:J127.114H
MDL:MFCD00130260
XlogP3:0.50 (est)
Molecular Weight:180.20324000
Formula:C10 H12 O3
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:natural substances and extractives
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.16300 @ 25.00 °C.
Boiling Point: 305.00 to 306.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.000449 mmHg @ 25.00 °C. (est)
Flash Point: 247.00 °F. TCC ( 119.70 °C. ) (est)
logP (o/w): 1.041 (est)
Soluble in:
 alcohol
 water, 1.101e+004 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
2-Propanone,1-(4-hydroxy-3-methoxyphenyl)- 95%
Odor: characteristic
Use: Volatile aromatic compound released from hard woods. It is often found in wine that has been aged in wood barrels
Carbosynth
For experimental / research use only.
4-Hydroxy-3-methoxyphenylacetone
Penta International
GUAIACYL ACETONE
Santa Cruz Biotechnology
For experimental / research use only.
4-Hydroxy-3-methoxyphenylacetone ≥98%
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-Hydroxy-3-methoxyphenylacetone 96%
sds
 
Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
natural substances and extractives
Recommendation for guaiacyl acetone usage levels up to:
 not for fragrance use.
 
Recommendation for guaiacyl acetone flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :17262
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
1-(4-hydroxy-3-methoxyphenyl)propan-2-one
Chemidplus:0002503460
 
References:
 1-(4-hydroxy-3-methoxyphenyl)propan-2-one
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):17262
Pubchem (sid):134983685
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2914.50.2000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
FLsmoke
 
Occurrence (nature, food, other):note
 mirabilis triflora
Search Trop Picture
 selinocarpus angustifolius
Search Trop Picture
 
Synonyms:
 acetone, 1-(4-hydroxy-3-methoxyphenyl)-
 guaiacylacetone
4-hydroxy-3-methoxyphenyl acetone
1-(4-hydroxy-3-methoxyphenyl) acetone
1-(4-hydroxy-3-methoxyphenyl)-2-propanone
1-(4-hydroxy-3-methoxyphenyl)acetone
1-(4-hydroxy-3-methoxyphenyl)propan-2-one
1-(4-hydroxy-3-methoxyphenyl)propanone
4-hydroxy-3-Methoxyphenylacetone
2-propanone, 1-(4-hydroxy-3-methoxyphenyl)-
2-propanone, 1-(4-hydroxy-3-methoxyphenyl)- (8CI)(9CI)
 vanillyl methyl ketone
 

Articles:

PubMed:Characterization of a new Providencia sp. strain X1 producing multiple xylanases on wheat bran.
PubMed:Effects of curcumin and related compounds on processes involving α-hydroxyethyl radicals.
PubMed:Biochemical characteristics of a textile dye degrading extracellular laccase from a Bacillus sp. ADR.
PubMed:Purification and characterization of an extracellular laccase from the anthracene-degrading fungus Fusarium solani MAS2.
PubMed:Changes in volatile aroma compounds of organic fragrant rice during storage under different conditions.
PubMed:Chemical and biochemical study of industrially produced San Simón da Costa smoked semi-hard cow's milk cheeses: Effects of storage under vacuum and different modified atmospheres.
PubMed:Separation of phenols and furfural by pervaporation and reverse osmosis membranes from biomass--superheated steam pyrolysis-derived aqueous solution.
PubMed:Melamine-formaldehyde-NTA chelating gel resin: Synthesis, characterization and application for copper(II) ion removal from synthetic wastewater.
PubMed:Targeting antioxidative signal transduction and stress response system: control of pathogenic Aspergillus with phenolics that inhibit mitochondrial function.
PubMed:Lignans from the bark extract of Pinus sylvestris L.
PubMed:Controlling food-contaminating fungi by targeting their antioxidative stress-response system with natural phenolic compounds.
PubMed:Easy synthesis of beta-O-4 type lignin related polymers.
PubMed:A UV resonance Raman (UVRR) spectroscopic study on the extractable compounds in Scots pine (Pinus sylvestris) wood. Part II. Hydrophilic compounds.
PubMed:Pre-extraction preparation (fresh, frozen, freeze-dried, or acetone powdered) and long-term storage of fruit and vegetable tissues: effects on antioxidant enzyme activity.
PubMed:Conformational study of a guaiacyl beta-O-4 lignin model compound by NMR. Examination of intramolecular hydrogen bonding interactions and conformational flexibility in solution.
PubMed:Purification and characterization of the main laccase produced by the white-rot fungus Pleurotus pulmonarius on wheat bran solid state medium.
PubMed:Purification and characterization of a peroxidase from corn steep water.
PubMed:Hemin (Fe(3+))-- and heme (Fe(2+))--smectite conjugates as a model of hemoprotein based on spectrophotometry.
PubMed:Purification and characterization of a new member of the laccase family from the white-rot basidiomycete Coriolus hirsutus.
PubMed:Polymerization of guaiacol by lignin-degrading manganese peroxidase from Bjerkandera adusta in aqueous organic solvents.
PubMed:Metabolism of 1-(4-hydroxy-3-methoxyphenyl)-2-propanone, a smoke flavour ketone, in rat.
PubMed:Petunia peroxidase a: isolation, purification and characteristics.
PubMed:In vivo and in vitro metabolism of 3,4-(methylenedioxy)methamphetamine in the rat: identification of metabolites using an ion trap detector.
PubMed:Anaerobic treatability of waste water from pulp and paper industries.
PubMed:Congenital goitre due to "thyroid peroxidase-iodinase defect".
PubMed:[Determination of amidopyrine, nicotinate of guaiacyl-ortho-hydroxybenzoate and lidocaine hydrochloride by differential potentiometric titration in a non-aqueous medium].
PubMed:Thyroid peroxidase. Nature of the heme binding to apoperoxidase.
PubMed:Indoleacetic acid oxidase activity of apoperoxidase.
PubMed:BEHAVIOR OF WATER IN CERTAIN HETEROGENEOUS SYSTEMS.
 
Notes:
a smoke flavor compound.
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