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

2,3,5-trimethyl phenol
phenol, 2,3,5-trimethyl-

Supplier Sponsors

Name:2,3,5-trimethylphenol
CAS Number: 697-82-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:211-806-9
FDA UNII:1S1061ZBQ1
Nikkaji Web:J43.368C
Beilstein Number:2042210
MDL:MFCD00002228
XlogP3-AA:2.70 (est)
Molecular Weight:136.19384000
Formula:C9 H12 O
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
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
Perfumer and Flavorist: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
Melting Point: 93.00 to 94.00 °C. @ 760.00 mm Hg
Boiling Point: 230.00 to 231.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.042000 mmHg @ 25.00 °C. (est)
Flash Point: 219.00 °F. TCC ( 103.60 °C. ) (est)
logP (o/w): 2.876 (est)
Soluble in:
 alcohol
 water, 762 mg/L @ 25 °C (exp)
Insoluble in:
 water
 
Organoleptic Properties:
Flavor Type: burnt
burnt coffee woody
Taste Description: burnt coffee woody
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
2,3,5-Trimethylphenol 95%
EMD Millipore
For experimental / research use only.
2,3,5-Trimethylphenol
Penta International
2,3,5-TRIMETHYL PHENOL
Santa Cruz Biotechnology
For experimental / research use only.
2,3,5-Trimethylphenol
Sigma-Aldrich: Aldrich
For experimental / research use only.
2,3,5-Trimethylphenol 99%
TCI AMERICA
For experimental / research use only.
2,3,5-Trimethylphenol >98.0%(GC)
 
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: fragrance agents
 
Recommendation for 2,3,5-trimethyl phenol flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
Env. Mutagen Info. Center:Search
EPA Substance Registry Services (TSCA):697-82-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12769
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
2,3,5-trimethylphenol
Chemidplus:0000697825
 
References:
 2,3,5-trimethylphenol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:697-82-5
Pubchem (cid):12769
Pubchem (sid):134976616
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEBI:View
CHEMBL:View
HMDB (The Human Metabolome Database):Search
FooDB:FDB005153
Export Tariff Code:2907.19.8000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
For Odor
caramellic
iso
propenyl pyrazine
FL/FR
For Flavor
burnt
iso
propenyl pyrazine
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 coffee bean
Search Trop Picture
 
Synonyms:
isopseudocumenol
1-hydroxy-2,3,5-trimethyl benzene
1-hydroxy-2,3,5-trimethylbenzene
 phenol, 2,3,5-trimethyl-
2,3,5-trimethylbenzolol
2,3,5-trimethylphenol
 

Articles:

US Patents:3,946,080 - Flavouring and perfuming ingredients
PubMed:Substrate specificity and enzyme recycling using chitosan immobilized laccase.
US Patents:Furfurylthioacetone
PubMed:Characterization of phenol and alkyl phenols in organic matrixes with monoethylene glycol extraction and multidimensional gas chromatography/mass spectrometry.
PubMed:Effects of coffee components on the response of GABA(A) receptors expressed in Xenopus oocytes.
PubMed:Gentisic acid and its 3- and 4-methyl-substituted homologoues as intermediates in the bacterial degradation of m-cresol, 3,5-xylenol and 2,5-xylenol.
 
Notes:
None found
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2018 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy