alpha,alpha-dimethyl anisyl acetone
homoethone
 
Notes:
None found
  • BOC Sciences
    • BOC Sciences
      Best of Chemicals Supplier
      Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecule and chiral compounds.
      BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services.
      BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies.
      Email: Marketing
      US Email: Marketing
      Email: Sales
      US Email: Sales
      Voice: 1-631-485-4226
      Fax: 1-631-614-7828
      US Voice: 1-631-485-4226
      US Fax: 1-631-614-7828
      Europe44-203-286-1088
      Facebook
      Twitter
      Linkedin
      Blog
      Get the App!
      Product(s):
      103-13-9 1-p-Methoxyphenyl-1-penten-3-one
       
Synonyms   Articles   Notes   Search
CAS Number: 103-13-9Picture of molecule3D/inchi
MDL: MFCD00026446
CoE Number: 719
XlogP3-AA: 3.00 (est)
Molecular Weight: 204.26892000
Formula: C13 H16 O2
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
CAS Number: 103-13-9  (E)Picture of molecule3D/inchi
XlogP3-AA: 3.00 (est)
Molecular Weight: 204.26892000
Formula: C13 H16 O2
NMR Predictor: Predict (works with chrome or firefox)
CAS Number: 103-13-9  (Z)Picture of molecule3D/inchi
XlogP3-AA: 3.00 (est)
Molecular Weight: 204.26892000
Formula: C13 H16 O2
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
JECFA Food Flavoring: 829  1-(4-methoxyphenyl)-4-methyl-1-penten-3-one
DG SANTE Food Flavourings: 07.049  1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
FEMA Number: 3760 homoethone
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):103-13-9 ; 1-(4-METHOXYPHENYL)-4-METHYL-1-PENTEN-3-ONE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
Synonyms   Articles   Notes   Search   Top
Physical Properties:
Appearance: colorless clear oily liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 1.01600 to 1.02600 @  25.00 °C.
Pounds per Gallon - (est).: 8.454 to  8.537
Refractive Index: 1.51000 to 1.51500 @  20.00 °C.
Melting Point: 28.00 °C. @ 760.00 mm Hg
Boiling Point: 217.00 to  219.00 °C. @ 40.00 mm Hg
Boiling Point: 201.00 °C. @ 10.00 mm Hg
Vapor Pressure: 0.000080 mmHg @ 25.00 °C. (est)
Flash Point: 302.00 °F. TCC ( 150.00 °C. )
logP (o/w): 3.011 (est)
Soluble in:
 alcohol
 water, very slightly
 water, 108.1 mg/L @ 25 °C (est)
Insoluble in:
 water
Synonyms   Articles   Notes   Search   Top
Organoleptic Properties:
 
Odor Type: caramellic
 
Odor Strength: low ,
recommend smelling in a 10.00 % solution or less
 
 caramellic  fruity  buttery  
Odor Description:
at 10.00 % in dipropylene glycol. 
caramel fruity buttery
 
Odor and/or flavor descriptions from others (if found).
 
 
Synonyms   Articles   Notes   Search   Top
Cosmetic Information:
None found
Synonyms   Articles   Notes   Search   Top
Suppliers:
Axsyn
For experimental / research use only.
1-Penten-3-one,1-(4-methoxyphenyl)-4-methyl-
BOC Sciences
For experimental / research use only.
1-p-Methoxyphenyl-1-penten-3-one
Parchem
alpha,alpha-dimethyl anisyl acetone
Sigma-Aldrich: Aldrich
For experimental / research use only.
1-(4-Methoxyphenyl)-4-methyl-1-penten-3-one
Synonyms   Articles   Notes   Search   Top
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
Synonyms   Articles   Notes   Search   Top
Safety in Use Information:
Category: flavor and fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for alpha,alpha-dimethyl anisyl acetone usage levels up to:
  0.2000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.30 (μg/capita/day)
Structure Class: II
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: 15
Click here to view publication 15
 average usual ppmaverage maximum ppm
baked goods: -10.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
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: --
 
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/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 3.76000-
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 0.10000-
Edible ices, including sherbet and sorbet (03.0): 0.55000-
Processed fruit (04.1): --
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 6.06500-
Chewing gum (05.0): --
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 30.00000-
Bakery wares (07.0): 4.12500-
Meat and meat products, including poultry and game (08.0): 6.88500-
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 10.00000-
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 0.40000-
Foodstuffs intended for particular nutritional uses (13.0): --
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 1.48500-
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 1.00000-
Ready-to-eat savouries (15.0): --
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): --
Synonyms   Articles   Notes   Search   Top
Safety References:
Flavor & Extract Manufacturers Association (FEMA) reference(s):
The FEMA GRAS assessment of aromatic substituted secondary alcohols, ketones, and related esters used as flavor ingredients. View pdf
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):
Scientific Opinion on Flavouring Group Evaluation 215 (FGE.215): Seven a,-Unsaturated Cinnamyl Ketones from subgroup 3.2 of FGE.19
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 215 Revision 1 (FGE.215Rev1): seven a,-unsaturated cinnamyl ketones from subgroup 3.2 of FGE.19
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 103-13-9
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 61003
National Institute of Allergy and Infectious Diseases: Data
 1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
Chemidplus: 0000103139
 (E)-1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
 (Z)-1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
Synonyms   Articles   Notes   Search   Top
References:
 1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 103-13-9
Pubchem (cid): 61003
Pubchem (sid): 505419
 (E)-1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 103-13-9
Pubchem (cid): 5373780
Pubchem (sid): 10426697
 (Z)-1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 103-13-9
Pubchem (cid): 6435821
Pubchem (sid): 197224
Synonyms   Articles   Notes   Search   Top
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
HMDB (The Human Metabolome Database): Search
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
acidic
 cyclohexyl acetic acidFL/FR
balsamic
2-acetyl furanFL/FR
 cinnamyl benzoateFL/FR
bready
 coffee furanoneFL/FR
buttery
 acetoinFL/FR
 acetyl isobutyrylFL/FR
 acetyl propionylFL/FR
isobutyl lactateFL/FR
 butyl octanoateFL/FR
2,3-heptane dioneFL/FR
3,4-hexane dioneFL/FR
2-oxobutyric acidFL/FR
 caramel pentadioneFL/FR
 cycloteneFL/FR
 cyclotene hydrateFL/FR
 ethyl 2-hydroxy-2-methyl butyrateFL/FR
 ethyl cyclopentenoloneFL/FR
 ethyl maltolFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 fenugreek absoluteFL/FR
 geranyl crotonateFR
 immortelle absoluteFL/FR
 levulinic acidFL/FR
isomaltol 
 maltolFL/FR
 maltyl propionateFL/FR
 maple furanoneFL/FR
 menthone lactoneFL/FR
 mesitene lactoneFR
5-methyl furfuralFL/FR
 rosefuranFL/FR
 shoyu furanoneFL/FR
 strawberry furanoneFL/FR
 strawberry furanone acetateFL/FR
 toffee furanoneFL/FR
coconut
gamma-heptalactoneFL/FR
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
coumarinic
 tonka bean resinoidFR
creamy
2,3-butane diolFR
gamma-butyrolactoneFL/FR
ethereal
 ethyl 4-pentenoateFL/FR
 ethyl pyruvateFL/FR
isovaleraldehyde propylene glycol acetalFL/FR
fatty
 butyl undecylenateFL/FR
fermented
 ethyl (E)-2-crotonateFL/FR
floral
 benzyl lactateFL/FR
 jasmin pyranoneFL/FR
 linalyl butyrateFL/FR
fruity
 acetoin acetateFL/FR
1-acetoxyacetoneFL/FR
gamma-decalactoneFL/FR
 ethyl lactateFL/FR
(E)-ethyl tiglateFL/FR
 prenyl isobutyrateFL/FR
 propylene glycol dibutyrate 
 tetrahydrofurfuryl acetateFL/FR
green
isoamyl 3-(2-furan) propionateFL/FR
(Z)-3-hexen-1-yl butyrateFL/FR
herbal
 butyl levulinateFL/FR
musty
3-acetyl-2,5-dimethyl furanFL/FR
nutty
2-acetyl-3,5(or 6)-dimethyl pyrazineFL/FR
2,3-dimethyl pyrazineFL/FR
2-ethyl pyrazineFL/FR
 nutty cyclohexenoneFL/FR
phenolic
4-methyl-2,6-dimethoxyphenolFL/FR
soapy
 ethyl undecanoateFL/FR
(E)-propyl 2-furan acrylateFL/FR
(E)-tiglic acidFL/FR
sweet
 vanilla oleoresin baliFL/FR
tonka
 tonka bean absoluteFR
tropical
delta-dodecalactoneFL/FR
vanilla
 ethyl vanillinFL/FR
 vanilla oleoresin bourbonFL/FR
 vanillyl isobutyrateFL/FR
vegetable
 tetrahydrofurfuryl alcoholFL/FR
 
For Flavor
 
No flavor group found for these
1-acetoxyacetoneFL/FR
4-acetyl-2,5-dimethyl-3(2H)-furanoneFL
2-acetyl-3,4,5,6-tetrahydropyridineFL
 allyl 2-furoateFL
 benzyl disulfideFL
 benzyl lactateFL/FR
 butyl octanoateFL/FR
 cinnamyl benzoateFL/FR
6-decenoic acidFL
2,5-diethyl tetrahydrofuranFL
 ethyl 2-hydroxy-2-methyl butyrateFL/FR
 ethyl 4-pentenoateFL/FR
 ethyl butyryl lactateFL
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 furfuryl acetoneFL
isomaltol 
 menthone lactoneFL/FR
3-(methyl thio) hexanalFL
 prenyl isobutyrateFL/FR
 propylene glycol dibutyrate 
 rosefuranFL/FR
 sodium 4-methyl-2-oxovalerateFL
 strawberry furanone ethyl etherFL
isoamyl 3-(2-furan) propionateFL/FR
acidic
 levulinic acidFL/FR
dextro,laevo-tartaric acidFL
alliaceous
3-tetrahydrothiophenoneFL
bready
 mango furanoneFL
brown
2-oxobutyric acidFL/FR
5-methyl furfuralFL/FR
 tetrahydrofurfuryl acetateFL/FR
(E)-tiglic acidFL/FR
burnt
 furfuryl alcoholFL
buttery
isobutyl lactateFL/FR
 butyroinFL
 diacetylFL
2,3-heptane dioneFL/FR
3,4-hexane dioneFL/FR
(E)-2-pentenoic acidFL
caramellic
 caramel furanoneFL
 caramel pentadioneFL/FR
 cycloteneFL/FR
 cyclotene hydrateFL/FR
 ethyl maltolFL/FR
5-ethyl-3,4,5,6-tetramethyl cyclohexen-2-oneFL
 fenugreek absoluteFL/FR
 maltolFL/FR
 maltyl propionateFL/FR
 maple furanoneFL/FR
3-methyl butyl 2-furyl butyrateFL
 shoyu furanoneFL/FR
 strawberry furanoneFL/FR
 strawberry furanone acetateFL/FR
 toffee furanoneFL/FR
coconut
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
coffee
2-thiophene thiolFL
creamy
 acetoinFL/FR
 acetyl isobutyrylFL/FR
delta-dodecalactoneFL/FR
 jasmin pyranoneFL/FR
fatty
 diacetyl trimerFL
(E,E)-2,4-undecadienalFL
2,4-undecadienalFL
floral
 linalyl butyrateFL/FR
fruity
 acetoin acetateFL/FR
gamma-decalactoneFL/FR
 ethyl lactateFL/FR
(E)-ethyl tiglateFL/FR
 furfuryl valerateFL
2-pentanoyl furanFL
(E)-propyl 2-furan acrylateFL/FR
isovaleraldehyde propylene glycol acetalFL/FR
green
2-furyl acetoneFL
(Z)-3-hexen-1-yl butyrateFL/FR
 immortelle absoluteFL/FR
herbal
 butyl levulinateFL/FR
5-hydroxymethyl furfuralFL
jammy
 ethyl cyclopentenoloneFL/FR
lactonic
gamma-heptalactoneFL/FR
milky
gamma-butyrolactoneFL/FR
musty
 ethyl (E)-2-crotonateFL/FR
nutty
2-acetyl furanFL/FR
3-acetyl-2,5-dimethyl furanFL/FR
2-acetyl-3,5(or 6)-dimethyl pyrazineFL/FR
 coffee furanoneFL/FR
2,3-dimethyl pyrazineFL/FR
2-ethyl pyrazineFL/FR
 nutty cyclohexenoneFL/FR
 peanut oxazoleFL
 tetrahydrofurfuryl alcoholFL/FR
phenolic
4-methyl-2,6-dimethoxyphenolFL/FR
rummy
 ethyl pyruvateFL/FR
sweet
 caramel dioneFL
 cyclohexyl acetic acidFL/FR
dextro-sorbitolFL
 vanilla oleoresin baliFL/FR
toasted
 acetyl propionylFL/FR
vanilla
 ethyl vanillinFL/FR
 vanilla oleoresin bourbonFL/FR
 vanillyl isobutyrateFL/FR
waxy
 butyl undecylenateFL/FR
 ethyl undecanoateFL/FR
 furfuryl octanoateFL
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 butterFR
 butterscotchFR
 caramelFL
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
homoethone
1-(4-methoxyphenyl)-4-methyl-1-penten-3-one
1-(p-methoxyphenyl)-4-methyl-1-penten-3-one
1-(para-methoxyphenyl)-4-methyl-1-penten-3-one
1-(4-methoxyphenyl)-4-methylpent-1-en-3-one
p-methoxystyryl isopropyl ketone
para-methoxystyryl isopropyl ketone
1-penten-3-one, 1-(4-methoxyphenyl)-4-methyl-
isopropyl 4-methoxystyryl ketone
isopropyl p-methoxystyryl ketone
Synonyms   Articles   Notes   Search   Top
Synonyms   Articles   Notes   Search   Top
Please share your Comments.
Email Address:
 
 
 
 
Top of Page Home
Copyright © 1980-2021 Perflavory ™ Disclaimer Privacy Policy