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

anethol
1-methoxy-4-(1-propenyl)benzene

Sponsors

Name:1-methoxy-4-prop-1-enylbenzene
CAS Number: 104-46-1Picture of molecule3D/inchi
Other:12002-40-3
ECHA EINECS - REACH Pre-Reg:203-205-5
FDA UNII:A79C64YD3Q
Beilstein Number:0774229
MDL:MFCD00009284
CoE Number:183
XlogP3:3.30 (est)
Molecular Weight:148.20484000
Formula:C10 H12 O
NMR Predictor:Predict (works with chrome 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
FLAVIS Number:04.088 (Old)
DG SANTE Food Flavourings:04.088 1-methoxy-4-(1-propenyl)benzene
 
Physical Properties:
Appearance:colorless to pale yellow liquid to solid (est)
Assay: 98.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Melting Point: 21.00 to 23.00 °C. @ 760.00 mm Hg
Boiling Point: 235.00 to 239.00 °C. @ 760.00 mm Hg
Boiling Point: 145.00 to 146.00 °C. @ 50.00 mm Hg
Vapor Pressure:0.069000 mm/Hg @ 25.00 °C. (est)
Flash Point: 191.00 °F. TCC ( 88.40 °C. ) (est)
logP (o/w): 3.390
Soluble in:
 alcohol
 water, 111 mg/L @ 25 °C (exp)
Similar Items:note
(E)-anethol
(Z)-anethol
dihydroanethol
 
Organoleptic Properties:
Odor Type: licorice
Odor Strength:medium
sweet anise licorice medicinal
Odor Description:at 100.00 %. sweet anise licorice medicinal
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: denaturants
masking agents
 
Suppliers:
ASIA IMPORT AND EXPORT
Natural Anethol
98.00 to 99 % sum of isomers
Aurochemicals
ANETHOLE, Natural
Bontoux
ANETHOL NATURAL ISOLATE
CG Herbals
Anethol
De Monchy Aromatics
Anethol
Odor: sweet, anise, licorice, mimosa
Inoue Perfumery
ANETHOL
M&U International
Anethole, Kosher
M&U International
NAT. ANETHOL
Noble Molecular Research
For experimental / research use only.
Anethol
O'Laughlin Industries
ANETHOLE NATURAL
Pearlchem Corporation
Anethole Natural
Perfumery Laboratory
ANETOL (ANETHOL)
Odor: Intense, sweet aroma of anise with aromatic nuances of liquorice
Treatt
Anethol Ex Fennel Natural
Treatt
Anethol
 
Safety Information:
 
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-guinea pig LD50 2160 mg/kg
BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

intraperitoneal-mouse LD50 593 mg/kg
Yakugaku Zasshi. Journal of Pharmacy. Vol. 104, Pg. 793, 1984.

oral-mouse LD50 3050 mg/kg
BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: COMA
Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

oral-rat LD50 2090 mg/kg
BEHAVIORAL: COMA BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

intraperitoneal-rat LD50 70 mg/kg
Journal of Agricultural and Food Chemistry. Vol. 17, Pg. 497, 1969.

oral-bird - wild LD50 316 mg/kg
Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.

intraperitoneal-rat LDLo 70 mg/kg
Journal of Agricultural and Food Chemistry. Vol. 17, Pg. 497, 1969.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 11, Pg. 863, 1973.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
 
 
Safety References:
EPI System: View
ClinicalTrials.gov:search
Daily Med:search
NLM Hazardous Substances Data Bank:Search
Chemical Carcinogenesis Research Information System:Search
Cancer Citations:Search
Toxicology Citations:Search
Carcinogenic Potency Database:Search
Env. Mutagen Info. Center:Search
NLM Developmental and Reproductive Toxicity:Search
EPA Substance Registry Services (TSCA):104-46-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :7703
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
1-methoxy-4-prop-1-enylbenzene
Chemidplus:0000104461
EPA/NOAA CAMEO:hazardous materials
RTECS:BZ9275000 for cas# 104-46-1
 
References:
 1-methoxy-4-prop-1-enylbenzene
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:104-46-1
Pubchem (cid):7703
Pubchem (sid):134972877
Pherobase:View
 
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
CHEMBL:View
KEGG (GenomeNet):C10428
HMDB (The Human Metabolome Database):Search
YMDB (Yeast Metabolome Database):YMDB01637
Haz-Map:View
MedlinePlusSupp:View
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
Formulations/Preparations:
grades: usp (technical); fcc (food chemicals codex).
 
Potential Blenders and core components note
For Odor
anise
sweet
fennel absolute
FL/FR
sweet
fennel oleoresin
FL/FR
foeniculum vulgare fruit extract
FL/FR
foeniculum vulgare mill. var. dulce d.c. fruit extract
FL/FR
anisic
para-
anisyl propanal
FR
dihydroanethol
FL/FR
ocimum basilicum leaf oil india
FL/FR
fruity
(E,E)-
ethyl sorbate
FL/FR
minty
foeniculum vulgare capillaceum fruit extract
FR
spicy
tarragon oil replacer
FL/FR
For Flavor
No flavor group found for these
tarragon oil replacer
FL/FR
anise
anise
sweet
fennel absolute
FL/FR
sweet
fennel oleoresin
FL/FR
foeniculum vulgare fruit extract
FL/FR
foeniculum vulgare mill. var. dulce d.c. fruit extract
FL/FR
fruity
(E,E)-
ethyl sorbate
FL/FR
(E,E)-
methyl sorbate
FL
herbal
dihydroanethol
FL/FR
ocimum basilicum leaf oil india
FL/FR
 
Potential Uses:
 denaturants
 
Occurrence (nature, food, other):note
 celery seed oil egypt @ 0.61%
Data GC Search Trop Picture
 helichrysum arenarium (l.) moench oil hungary @ 3.20%
Data GC Search Trop Picture
 liriodendron chinense
Search Trop Picture
 liriodendron tulipifera
Search Trop Picture
 magnolia southern magnolia
Search Trop Picture
 michelia compressa
Search Trop Picture
 osmanthus absolute @ 0.06%
Data GC Search Trop Picture
 
Synonyms:
 acintene O
 anethol ex fennel natural
 anethol natural
 anethol natural isolate
p-anethole
para-anethole
 anethole natural
 anethole NF/FCC synthetic
 anethole rectified, natural
 anise camphor
isoestragole
4-methoxy-1-propenyl benzene
1-methoxy-4-(1-propenyl) benzene
1-methoxy-4-(1-propenyl)benzene
1-methoxy-4-prop-1-enylbenzene
1-methoxy-4-propenyl benzene
p-methoxy-beta-methyl styrene
para-methoxy-beta-methyl styrene
4-methoxypropenyl benzene
 monasirup
4-propenyl anisole
p-propenyl anisole
para-propenyl anisole
para-1-propenyl anisole
p-propenyl methoxybenzene
para-propenyl methoxybenzene
p-propenyl phenyl methyl ether
para-propenyl phenyl methyl ether
4-propenylanisole
p-propenylanisole
para-propenylanisole
 

Articles:

PubMed:Oral fennel (Foeniculum vulgare) drop effect on primary dysmenorrhea: Effectiveness of herbal drug.
PubMed:Effect of naturally occurring antimicrobials and chemical preservatives on the growth of Aspergillus Parasiticus.
PubMed:Anti-inflammatory effects of several plant extracts on porcine alveolar macrophages in vitro.
PubMed:Chemical composition and in vitro cytotoxic, genotoxic effects of essential oil from Urtica dioica L.
PubMed:Perinatal flavour learning and adaptation to being weaned: all the pig needs is smell.
PubMed:An examination of the potential effect of lipids on the first-pass metabolism of the lipophilic drug anethol trithione.
PubMed:Brazilian red propolis: unreported substances, antioxidant and antimicrobial activities.
PubMed:Functional involvement of Ca(2+) and Ca(2+)-activated K(+) channels in anethol-induced changes in Ca(2+) dependent excitability of F1 neurons in Helix aspersa.
PubMed:[The clinical therapic efficiency of anethol trithione on dry eye].
PubMed:Phytochemical analysis and allelopathic activity of essential oils of Ecballium elaterium A. Richard growing in Iran.
PubMed:Lipid-based formulations to enhance oral bioavailability of the poorly water-soluble drug anethol trithione: effects of lipid composition and formulation.
PubMed:Development of an attractant-baited trap for Oxythyrea funesta Poda (Coleoptera: Scarabaeidae, Cetoniinae).
PubMed:The life of an anise-flavored alcoholic beverage: does its stability cloud or confirm theory?
PubMed:Effects of essential oils from fennel (Foeniculi aetheroleum) and caraway (Carvi aetheroleum) in pigs.
PubMed:Molecular targets of dietary agents for prevention and therapy of cancer.
PubMed:Plant extracts affect in vitro rumen microbial fermentation.
PubMed:Secondary metabolites from Ganoderma lucidum and Spongiporus leucomallellus.
PubMed:Spontaneously formed trans-anethol/water/alcohol emulsions: mechanism of formation and stability.
PubMed:Effect of some volatile oils on the affinity of intact and oxidized low-density lipoproteins for adrenal cell surface receptors.
PubMed:Suppression of the nuclear factor-kappaB activation pathway by spice-derived phytochemicals: reasoning for seasoning.
PubMed:Role of chemopreventive agents in cancer therapy.
PubMed:From chemoprevention to chemotherapy: common targets and common goals.
PubMed:Improved growth and essential oil yield and quality in Foeniculum vulgare mill on mycorrhizal inoculation supplemented with P-fertilizer.
PubMed:Phytochemical characterization of essential oil from Ocimum selloi.
PubMed:[New data on composition of esssential oil from inflorescence of everlasting (Helichrysum arenarium(L.) Moench.)].
PubMed:Inhibition of oxidation of human low-density lipoproteins by phenolic substances in different essential oils varieties.
PubMed:Assessment of the role of glutathione conjugation in the protection afforded by anethol dithiolthione against hexachloro-1,3-butadiene-induced nephrotoxicity.
PubMed:Kairomone from dandelion,Taraxacum officinale, attractant for scarab beetleAnomala octiescostata.
PubMed:Protective effect of anethol dithiolthione against acetaminophen hepatotoxicity in mice.
PubMed:Cerebral chemosensory evoked potentials elicited by chemical stimulation of the human olfactory and respiratory nasal mucosa.
PubMed:Identification and quantitation of a metabolite of anethol dithiolthione in rat and mouse urine using high-performance liquid chromatography.
PubMed:Inhibitory effects of spices on growth and toxin production of toxigenic fungi.
PubMed:[Experimental psychotropic action of cis and trans isomers of anethol].
PubMed:[Quantitative determination of anethol in the raw materials and products of hydrobromine treatment in the production of sinestrol].
PubMed:[Studies on the solubility of terpin hydrate and anethol].
PubMed:[Chronic toxicity of trans-anethol and of anisated liqueurs with a base of anethol and licorice].
PubMed:[Studies on the pattern of metal-catalyzed oxidation in ethereal oils (anethol)].
 
Notes:
an isomer of estragole; structurally similar to capsaicin; has some neurological and insecticidal and skin absorption effects.
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