para-methyl anisole

p-methylanisole

CAS: 104-93-8 C8 H10 O MW: 122.16690000 naphthyl naphthyl

Identification

Namepara-methyl anisole
IUPAC1-methoxy-4-methylbenzene
CAS Number104-93-8
EINECS203-253-7
FDA UNII10FAI0OR9W
Molecular FormulaC8 H10 O
Molecular Weight122.16690000
MDL NumberMFCD00008413
Nikkaji NumberJ10.114A
Beilstein1237336
CoE Number188
XlogP32.70 (est)

Regulatory

JECFA Food Flavoring1243 p-methylanisole
DG SANTE Food Flavourings04.015 1-methoxy-4-methylbenzene
FEMA Number2681
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)104-93-8 ; P-METHYLANISOLE
FDA RegulationFDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION

Physical Properties

Appearance colorless clear liquid (est)
Assay 99.00 to 100.00
Food Chemicals Codex Listed Yes
Specific Gravity 0.99600 to 1.00400 @ 25.00 °C.
Pounds per Gallon - (est). 8.288 to 8.354
Refractive Index 1.51000 to 1.51300 @ 20.00 °C.
Melting Point -32.00 °C. @ 760.00 mm Hg
Boiling Point 175.50 °C. @ 760.00 mm Hg
Vapor Pressure 2.029000 mmHg @ 25.00 °C. (est)
Flash Point 128.00 °F. TCC ( 53.33 °C. )
logP (o/w) 2.660
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
Insoluble in glycerin
Stability non-discoloring in most media

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

Organoleptic Properties

Odor Strength high ,
Substantivity 8 hour(s) at 100.00 %
Odor Description
at 1.00 % in dipropylene glycol.
Naphthyl, phenolic, camphoraceous, minty, powdery and nutty
strong leather with nuances reminiscent of para-cresol
cedar; sweet; vanilla; camphoraceous
floreal,camphoraceous, phenolic, in dilution Ylang Ylang, cananga
aromatic-phenolic floral daffodil ylang cananga naphthyl phenolic camphor mint powdery nutty
Odor sample from Ungerer & Company, Inc.
Taste Description
at 20.00 ppm.
vanilla-, chocolate-, nut-like, slightly phenolic
naphthyl phenolic camphor cooling woody
camphoraceous, woody, phenolic, fresh

Safety Information

Preferred SDSView
European informationMost important hazard(s):
Human Experience2 % solution: no irritation or sensitization.
Oral/Parenteral Toxicityoral-rat LD50 [sex: M,F] 1920 mg/kg
Dermal Toxicityskin-rabbit LD50 > 5000 mg/kg
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryflavor and fragrance agents
RIFM Fragrance Material Safety AssessmentSearch
Recommendation for para-methyl anisole usage levels up to2.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU)0.49 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA)15.00 (μg/capita/day)
Structure ClassI
baked goods-
beverages(nonalcoholic)-
beverages(alcoholic)-
breakfast cereal-
cheese-
chewing gum-
condiments / relishes-
confectionery froastings-
egg products-
fats / oils-
fish products-
frozen dairy-
fruit ices-
gelatins / puddings0.50000
granulated sugar-
gravies-
hard candy-
imitation dairy-
instant coffee / tea-
jams / jellies-
meat products-
milk products-
nut products-
other grains-
poultry-
processed fruits-
processed vegetables-
reconstituted vegetables-
seasonings / flavors-
snack foods-
soft candy-
soups-
sugar substitutes-
sweet sauces-

ACS International GmbH

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Augustus Oils Ltd

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Indukern, S.A. F&F Ingredients Division

Commitment to quality

Idukern F&F Ingredients is your partner for the fragrance and flavor ingredients.

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Lluch Essence S.L.

A family company dedicated to sales and distribution

Flexibility, availability, price and quality.

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Moellhausen S.P.A.

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Penta International Corporation

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PerfumersWorld Ltd.

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Prodasynth

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Sigma-Aldrich

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SRS Aromatics Ltd

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Taytonn ASCC Pte Ltd

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The Good Scents Company

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The John D. Walsh Company, Inc

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The Lermond Company

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R C Treatt and Co Ltd

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Vigon International

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Potential Uses

FR champaca FR cherry blossom FR currant black currant FR floral FR genet FR grape FR hay new mown hay FR hyacinth FR jasmin FR jonquil FR lilac FR lily FR mulberry FR narcissus FL nut FR rose FR sandalwood tide FR tuberose FR wallflower FL walnut FR wisteria FR ylang ylang

Natural Occurrence

cananga cananga odorata oil java @ 2.14% Data cananga oil china @ 2.05% Data champaca concrete @ trace% Data cheese PMC cheese gorgonzola cheese PMC croton flavens l. (welensali) leaf oil curacao @ trace% Data hyacinthus orientalis absolute @ 0.01-0.02% Data lavender oil spike spain @ 0.009% Data tomato ylang ylang ylang ylang oil @ 0.34% Data ylang ylang oil CO2 extract @ 2.00% Data ylang ylang oil I (cananga odorata hook. f. and thomas.) @ 5.75% Data ylang ylang oil II (cananga odorata hook. f. and thomas.) @ 1.19% Data ylang ylang oil III @ 0.39% Data

Synonyms

anisole, p-methyl- benzene, 1-methoxy-4-methyl- p- cresol methyl ether para- cresol methyl ether p- cresyl methyl ether para- cresyl methyl ether p- cresyl methyl ether ( p – cresol ) p- cresyl methyl ether FCC cresyl methyl ether para cresyl methyl ether para FCC 1- methoxy-4-methyl benzene 1- methoxy-4-methyl-benzene 1- methoxy-4-methylbenzene 4- methoxytoluene p- methoxytoluene para- methoxytoluene methyl 4-methyl phenyl ether methyl 4-methylphenyl ether 4- methyl anisole p- methyl anisole para- methyl anisole para- methyl cresol methyl p-cresol o- methyl p-cresol methyl p-cresyl ether methyl p-methylphenyl ether methyl p-tolyl ether methyl para cresol ortho- methyl para-cresol methyl para-cresyl ether methyl para-methyl phenyl ether methyl para-tolyl ether 4- methyl phenol methyl ether 4- methyl-1-methoxybenzene 1- methyl-4-methoxybenzene methyl-para-cresol 4- methylanisole p- methylanisole para- methylanisole 4- methylcresol p- methylcresol 4- methylphenol methyl ether toluene, 4-methoxy- p- tolyl methyl ether para- tolyl methyl ether PubMed: Noncovalent functionalization of graphene with a Ni(II) tetraaza[14]annulene complex. PubMed: High resolution electronic spectroscopy of 4-methylanisole in the gas phase. Barrier height determinations for the methyl group torsional motion. PubMed: Private channels in plant-pollinator mutualisms. PubMed: Functionalization of the methylene bridges of the calix[6]arene scaffold. PubMed: A concise synthesis of (+/-)-cacalol. PubMed: Vibrations and theoretical calculations of p-methylanisole in the first electronically excited S1 and ionic ground D0 states. PubMed: Orientational isomerism and binding ability of nonsymmetrical guests encapsulated in a self-assembling heterodimeric capsule. PubMed: Total synthesis of (+/-)-herbertenolide by stereospecific formation of vicinal quaternary centers in a crystalline ketone. PubMed: Individual solvent/solute interactions through social isomerism. PubMed: Total synthesis of nucleobase-modified adenophostin A mimics. PubMed: An assessment of the reaction energetics for cytochrome P450-mediated reactions. PubMed: Odour-impact compounds of Gorgonzola cheese. PubMed: Solubilization Site of Organic Perfume Molecules in Sodium Dodecyl Sulfate Micelles: New Insights from Proton NMR Studies. PubMed: Inhibitory and noninhibitory monoclonal antibodies to human cytochrome P450 2E1. PubMed: Studies on the mechanism of hepatotoxicity of 4-methylphenol (p-cresol): effects of deuterium labeling and ring substitution. PubMed: Chloroperoxidase-catalyzed benzylic hydroxylation. PubMed: Four-week toxicity study of 4-methoxytoluene in rats. PubMed: Occurrence of aromatic methyl migration (NIH-shift) during oxidation of p-methylanisole by hemin-thiolester complex as a cytochrome P-450 model.