2,4,6-trimethyl phenol
2,4,6-trimethylphenol

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  BOC Sciences

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  527-60-6 2,4,6-Trimethylphenol

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  Penta International Corporation

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  For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
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  Sigma-Aldrich

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  Sigma-Aldrich is a leading Life Science and High Technology company dedicated to providing high-quality, safe and certified flavor ingredients with transparent and easily accessible documentation to customers around the globe. Sigma-Aldrich also provides a suite of analytical tools that allow food analysts to simplify sample preparation, cleanup and analysis steps, while increasing sensitivity to trace ingredients and harmful substances to meet regulations and quality standards.
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  Product(s):
  W432900 2,4,6-Trimethylphenol, 99%, FG
  SDS

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  TCI AMERICA

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  Product(s):
  T0486 2,4,6-Trimethylphenol >98.0%(GC)
  SDS

CAS Number: 527-60-6 3D/inchi ECHA EINECS - REACH Pre-Reg: 208-419-2 FDA UNII: FPZ32614N6 Nikkaji Web: J6.671K Beilstein Number: 1859675 MDL: MFCD00002235 XlogP3-AA: 2.70 (est) Molecular Weight: 136.19384000 Formula: C9 H12 O BioActivity Summary: listing NMR Predictor: Predict (works with chrome, Edge or firefox) Category:flavor and 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 JECFA Food Flavoring: 2013 2,4,6-trimethylphenol DG SANTE Food Flavourings: 04.095 2,4,6-trimethylphenol FEMA Number: 4329 2,4,6-trimethylphenol FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 527-60-6 ; 2,4,6-TRIMETHYLPHENOL   Physical Properties: Appearance: pale red brown crystalline powder (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Melting Point: 73.00 to 74.00 °C. @ 760.00 mm Hg Boiling Point: 220.00 °C. @ 760.00 mm Hg Boiling Point: 95.00 °C. @ 10.00 mm Hg Vapor Pressure: 0.100000 mmHg @ 25.00 °C. (est) Flash Point: 206.00 °F. TCC ( 96.67 °C. ) logP (o/w): 2.730 Shelf Life: 24.00 month(s) or longer if stored properly. Storage: store in cool, dry place in tightly sealed containers, protected from heat and light. Soluble in:   alcohol   water, 1200 mg/L @ 25 °C (exp) Insoluble in:   water   Organoleptic Properties: Odor Type: phenolic phenolic coffee Odor Description:at 0.10 % in propylene glycol. mild phenolic coffee grounds Flavor Type: phenolic phenolic coffee Taste Description: phenolic coffee grounds Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. 2,4,6-Trimethylphenol Parchem 2,4,6-trimethyl phenol Penta International 2,4,6-TRIMETHYLPHENOL Santa Cruz Biotechnology For experimental / research use only. 2,4,6-Trimethylphenol Sigma-Aldrich 2,4,6-Trimethylphenol, 99%, FG sds Certified Food Grade Products TCI AMERICA For experimental / research use only. 2,4,6-Trimethylphenol >98.0%(GC) sds   Safety Information: Preferred SDS: View European information : Most important hazard(s): C - Corrosive. R 34 - Causes burns. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection. S 45 - In case of accident or if you feel unwell seek medical advice immediately.   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: oral-mouse LD50 10000 mg/kg Bromatologia i Chemia Toksykologiczna. Vol. 14, Pg. 301, 1981. intraperitoneal-mouse LD50 > 1000 mg/kg Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 201, 1960. Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavor and fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice   Maximised Survey-derived Daily Intakes (MSDI-EU): 0.0097 (μg/capita/day) Modified Theoretical Added Maximum Daily Intake (mTAMDI): 420 (μg/person/day) Threshold of Concern: 1800 (μg/person/day) Structure Class: I Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library publication number: 23 Click here to view publication 23   average usual ppm average maximum ppm baked goods: 0.10000 0.50000 beverages(nonalcoholic): 1.00000 5.00000 beverages(alcoholic): 1.00000 5.00000 breakfast cereal: - - cheese: 0.01000 0.05000 chewing gum: - - condiments / relishes: 0.01000 0.05000 confectionery froastings: 1.00000 5.00000 egg products: - - fats / oils: - - fish products: 0.01000 0.05000 frozen dairy: 0.01000 0.05000 fruit ices: 0.10000 0.50000 gelatins / puddings: 0.01000 0.05000 granulated sugar: - - gravies: 0.01000 0.05000 hard candy: - - imitation dairy: 0.01000 0.05000 instant coffee / tea: - - jams / jellies: - - meat products: 0.01000 0.05000 milk products: 0.01000 0.05000 nut products: - - other grains: - - poultry: 0.01000 0.05000 processed fruits: 0.01000 0.05000 processed vegetables: 0.01000 0.05000 reconstituted vegetables: - - seasonings / flavors: 0.01000 0.05000 snack foods: 0.01000 0.05000 soft candy: - - soups: 0.01000 0.05000 sugar substitutes: - - sweet sauces: 0.01000 0.05000   Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i). Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.   average usage mg/kg maximum usage mg/kg Dairy products, excluding products of category 02.0 (01.0): 0.50000 2.50000 Fats and oils, and fat emulsions (type water-in-oil) (02.0): 0.20000 1.00000 Edible ices, including sherbet and sorbet (03.0): 0.50000 2.50000 Processed fruit (04.1): 0.40000 2.00000 Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): - - Confectionery (05.0): 1.00000 5.00000 Chewing gum (05.3): - - Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 0.20000 1.00000 Bakery wares (07.0): 2.00000 10.00000 Meat and meat products, including poultry and game (08.0): 0.20000 1.00000 Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 0.20000 1.00000 Eggs and egg products (10.0): - - Sweeteners, including honey (11.0): - - Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 0.30000 1.50000 Foodstuffs intended for particular nutritional uses (13.0): 0.50000 2.50000 Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 0.20000 1.00000 Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 1.00000 5.00000 Ready-to-eat savouries (15.0): 2.00000 10.00000 Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 0.40000 2.00000   Safety References: European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... European Food Safety Authority (EFSA) reference(s): Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 22 (FGE.22): Ring-substituted phenolic substances from chemical groups 21 and 25 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf Flavouring Group Evaluation 58 (FGE.58) Consideration of phenol derivatives evaluated by JECFA (55th meeting) structurally related to ring substituted phenolic substances evaluated by EFSA in FGE.22 (2006) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf Flavouring Group Evaluation 60 (FGE.60): Consideration of eugenol and related hydroxyallylbenzene derivatives evaluated by JECFA (65th meeting) structurally related to ring- substituted phenolic substances evaluated by EFSA in FGE.22 (2006) View page or View pdf Scientific Opinion on Flavouring Group Evaluation 22, Revision 1 (FGE.22Rev1): Ring-substituted phenolic substances from chemical groups 21 and 25 View page or View pdf EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):527-60-6 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :10698 National Institute of Allergy and Infectious Diseases:Data WISER:UN 2430 WGK Germany:2 2,4,6-trimethylphenol Chemidplus:0000527606 RTECS:OX6590000 for cas# 527-60-6   References:   2,4,6-trimethylphenol NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 527-60-6 Pubchem (cid): 10698 Pubchem (sid): 134978605   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 FDA Substances Added to Food (formerly EAFUS): View CHEMBL: View HMDB (The Human Metabolome Database): HMDB32544 FooDB: FDB010421 Export Tariff Code: 2907.19.5000 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View Wikipedia: View FAO: 2,4,6-Trimethylphenol   Potential Blenders and core components note None Found   Potential Uses: None Found   Occurrence (nature, food, other):note   prunus mahaleb Search Trop Picture   Synonyms:   benzene, 2-hydroxy-1,3,5-trimethyl-   benzene,1-hydroxy,2,4,6-trimethyl 3,5- dimethyl-4-hydroxytoluene 1- hydroxy-2,4,6-trimethyl benzene 1- hydroxy-2,4,6-trimethylbenzene 2- hydroxymesitylene   mesitol   mesityl alcohol   phenol, 2,4,6-trimethyl-   phenol,2,4,6-trimethyl- 1,3,5- trimethyl phenol 2,4,6- trimethyl-phenol 1,3,5- trimethylphenol 2,3,4- trimethylphenol 2,4,6- trimethylphenol   Articles: US Patents:3,946,080 - Flavouring and perfuming ingredients US Patents:Furfurylthioacetone

Notes: Used as a food additive [EAFUS]