ortho-methyl acetophenone
2-methylacetophenone
 
Notes:
Used as a food additive [EAFUS]
  • BOC Sciences
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      Product(s):
      577-16-2 2-Methylacetophenone 95%
       
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      Product(s):
      13-26450 2-METHYLACETOPHENONE
       
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      Product(s):
      M0172 2'-Methylacetophenone >98.0%(GC)
       
Synonyms   Articles   Notes   Search
CAS Number: 577-16-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 209-408-5
FDA UNII: 23O5EV975S
Nikkaji Web: J45.639J
Beilstein Number: 0907005
MDL: MFCD00008734
XlogP3-AA: 2.00 (est)
Molecular Weight: 134.17790000
Formula: C9 H10 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: 2044  2-methylacetophenone
DG SANTE Food Flavourings: 07.259  2-methylacetophenone
FEMA Number: 4316 2-methylacetophenone
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):577-16-2 ; 2-METHYLACETOPHENONE
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 1.02300 to 1.02900 @  25.00 °C.
Pounds per Gallon - (est).: 8.512 to  8.562
Refractive Index: 1.52600 to 1.53200 @  20.00 °C.
Boiling Point: 214.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.159000 mmHg @ 25.00 °C. (est)
Vapor Density: 4.63 ( Air = 1 )
Flash Point: 182.00 °F. TCC ( 83.33 °C. )
logP (o/w): 2.125 (est)
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, 1123 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: floral
 
Odor Strength: medium
 
Substantivity: 27 hour(s) at 100.00 %
 
 sweet  hawthorn  powdery  anisic  coumarinic  phenolic  burnt  nutty  honey  
Odor Description:
at 100.00 %. 
sweet hawthorn powdery anisic coumarinic phenolic burnt nutty honey
Luebke, William tgsc, (2008)
 
 
Flavor Type: anisic
 
 anisic  coumarinic  phenolic  burnt  nutty  nut flesh  almond  powdery  
Taste Description:
sweet anisic coumarinic phenolic burnt nutty nut flesh almond powdery
Luebke, William tgsc, (2008)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
2-Methylacetophenone 95%
Penta International
2-METHYLACETOPHENONE
Santa Cruz Biotechnology
For experimental / research use only.
2'-Methylacetophenone
Sigma-Aldrich: Aldrich
For experimental / research use only.
2'-Methylacetophenone 98%
TCI AMERICA
For experimental / research use only.
2'-Methylacetophenone >98.0%(GC)
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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
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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
Recommendation for ortho-methyl acetophenone usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 1600 (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 ppmaverage maximum ppm
baked goods: 5.0000025.00000
beverages(nonalcoholic): 2.0000010.00000
beverages(alcoholic): --
breakfast cereal: 2.0000010.00000
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: 4.0000020.00000
egg products: --
fats / oils: 2.0000010.00000
fish products: 1.000005.00000
frozen dairy: --
fruit ices: 3.0000015.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 1.000005.00000
milk products: 3.000005.00000
nut products: 2.0000010.00000
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: 2.0000010.00000
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): 3.000005.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 2.0000010.00000
Edible ices, including sherbet and sorbet (03.0): 3.0000015.00000
Processed fruit (04.1): 2.0000010.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): 2.0000010.00000
Confectionery (05.0): 4.0000020.00000
Chewing gum (05.0): --
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 2.0000010.00000
Bakery wares (07.0): 5.0000025.00000
Meat and meat products, including poultry and game (08.0): 1.000005.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 1.000005.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 2.0000010.00000
Foodstuffs intended for particular nutritional uses (13.0): 3.0000015.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 2.0000010.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 4.0000020.00000
Ready-to-eat savouries (15.0): 5.0000025.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 2.0000010.00000
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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):
Flavouring Group Evaluation 16, Revision 1 (FGE.16Rev1)[1]: Aromatic ketones from chemical group 21- Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf
Flavouring Group Evaluation 16, Revision 2 (FGE.16Rev2): Aromatic ketones from chemical group 21
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 11340
National Institute of Allergy and Infectious Diseases: Data
WISER: UN 1993
WGK Germany: 3
 1-(2-methylphenyl)ethanone
Chemidplus: 0000577162
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References:
 1-(2-methylphenyl)ethanone
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 11340
Pubchem (sid): 134976887
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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
KEGG (GenomeNet): C07874
HMDB (The Human Metabolome Database): HMDB32386
FooDB: FDB009806
Export Tariff Code: 2914.39.9000
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
FAO: 2-Methylacetophenone
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
No odor group found for these
 pyrazinylmethylthiol acetate 
 robinia pseudoacacia absoluteFR
aldehydic
 dodecanal (aldehyde C-12 lauric)FL/FR
 nonanal (aldehyde C-9)FL/FR
10-undecenal (aldehyde C-11 undecylenic)FL/FR
amber
 cistus ladaniferus resinoidFL/FR
animal
isobutyl quinolineFR
anisic
ortho-acetanisoleFL/FR
para-acetanisoleFL/FR
para-anisaldehydeFL/FR
ortho-anisaldehydeFL/FR
balsamic
2-acetyl furanFL/FR
isoamyl benzoateFL/FR
 amyris wood oilFL/FR
siam benzoin resinoidFL/FR
 benzophenoneFR
 benzyl benzoateFL/FR
 benzyl salicylateFL/FR
laevo-bornyl acetateFL/FR
isobornyl acetateFL/FR
isobutyl cinnamateFL/FR
 cinnamyl alcoholFL/FR
 clover nitrileFR
 ethyl cinnamateFL/FR
 fir balsam absoluteFR
 methyl (E)-cinnamateFL/FR
3-phenyl propyl alcoholFL/FR
berry
 raspberry ketoneFL/FR
 raspberry ketone methyl etherFL/FR
bready
 furfuralFL/FR
citrus
 bergamot oil bergaptene reduced italyFL/FR
sweet orange peel oil c.p. brazilFL/FR
coconut
gamma-heptalactoneFL/FR
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
gamma-octalactoneFL/FR
fatty
 coconut absoluteFL/FR
 decanolFL/FR
floral
 acetophenoneFL/FR
alpha-amyl cinnamaldehydeFL/FR
isoamyl salicylateFL/FR
para-anisaldehyde / methyl anthranilate schiff's baseFR
para-anisyl acetaldehydeFL/FR
para-anisyl nitrileFR
 benzyl acetateFL/FR
 benzyl alcoholFL/FR
 bois de rose oil brazilFL/FR
isobutyl salicylateFL/FR
 cassie absoluteFL/FR
 cassie absolute replacerFL/FR
 cassie concreteFR
 cassie perfume baseFR
 cassie specialty (acacia farnesiana)FR
 citronellolFL/FR
 coriander seed oilFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinolFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 ethyl phenyl acetateFL/FR
 floral pyranolFR
 geraniolFL/FR
 hawthorn acetateFR
 hawthorn fragranceFR
 hawthorn specialtyFR
 heliotrope fragranceFR
 heliotrope specialtyFR
 heliotropinFL/FR
 heliotropyl diethyl acetalFR
(Z)-3-hexen-1-yl salicylateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hyacinth etherFR
 hydroxycitronellalFL/FR
 leerallFR
 lilyallFR
laevo-linaloolFL/FR
 linaloolFL/FR
 linalool oxideFL/FR
para-methyl acetophenoneFL/FR
 methyl dihydrojasmonateFL/FR
 mimosa absolute franceFL/FR
 muguet carboxaldehydeFR
 nerolFL/FR
 nonanolFL/FR
 ocean propanalFL/FR
alloocimeneFL/FR
 orris pyridine 25% IPMFR
 phenethyl alcoholFL/FR
 phenethyl phenyl acetateFL/FR
 phenethyl propionateFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 tetrahydrolinaloolFL/FR
fruity
 benzyl propionateFL/FR
 methyl anthranilateFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
green
(Z)-3-hexen-1-yl benzoateFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
3-phenyl propionaldehydeFL/FR
hay
 beeswax absoluteFL/FR
 hay absoluteFR
herbal
 carum carvi fruit oilFL/FR
 clary sage oil franceFL/FR
 linalyl acetateFL/FR
 sunflower oilFL/FR
honey
 methyl phenyl acetateFL/FR
mossy
 oakmoss absoluteFL/FR
 veramoss (IFF)FR
naphthyl
para-methyl anisoleFL/FR
beta-naphthyl ethyl etherFL/FR
beta-naphthyl methyl etherFL/FR
nutty
2-acetyl-3-methyl pyrazineFL/FR
2,4,5-trimethyl oxazoleFL/FR
phenolic
 ethyl vanillateFL/FR
2'-hydroxyacetophenoneFL/FR
powdery
para-anisyl alcoholFL/FR
spicy
 acacia fragranceFR
 allspice oilFL/FR
 benzyl isoeugenolFL/FR
 carnation absoluteFR
 cassia bark oil chinaFL/FR
 clove bud oilFL/FR
 eugenolFL/FR
alpha-methyl cinnamaldehydeFL/FR
 methyl isoeugenolFL/FR
terpenic
alpha-terpineolFL/FR
tobacco
 methyl benzoxoleFL/FR
tonka
 coumarinFR
gamma-hexalactoneFL/FR
 tonka bean absoluteFR
vanilla
 ethyl vanillinFL/FR
 vanilla bean absolute (vanilla planifolia)FL/FR
 vanillyl acetateFL/FR
waxy
1-dodecanolFL/FR
 ethyl laurateFL/FR
woody
 amber carbinolFR
 cistus twig/leaf oilFL/FR
 cyperus root oil (cyperus rotundus)FR
 guaiacwood oilFL/FR
 gurjun balsam oilFR
 methyl cedryl ketoneFL/FR
 patchouli ethanoneFR
4-isopropyl phenolFL/FR
 santallFR
 tobacarol (IFF)FR
 vetiver oil haitiFL/FR
 woody acetateFR
(Z)-woody amyleneFR
 woody propanolFR
 
For Flavor
 
No flavor group found for these
para-anisyl acetaldehydeFL/FR
 cassie absolute replacerFL/FR
 cistus ladaniferus resinoidFL/FR
 methyl (E)-cinnamateFL/FR
aldehydic
 nonanal (aldehyde C-9)FL/FR
anisic
para-acetanisoleFL/FR
ortho-anisaldehydeFL/FR
balsamic
siam benzoin resinoidFL/FR
 benzyl benzoateFL/FR
 benzyl salicylateFL/FR
laevo-bornyl acetateFL/FR
isobutyl cinnamateFL/FR
 ethyl cinnamateFL/FR
berry
 raspberry ketoneFL/FR
 raspberry ketone methyl etherFL/FR
brown
 beeswax absoluteFL/FR
 furfuralFL/FR
burnt
4-isopropyl phenolFL/FR
2,4,5-trimethyl oxazoleFL/FR
cherry
 heliotropinFL/FR
citrus
 bergamot oil bergaptene reduced italyFL/FR
laevo-linaloolFL/FR
 linaloolFL/FR
 nerolFL/FR
alloocimeneFL/FR
sweet orange peel oil c.p. brazilFL/FR
alpha-terpineolFL/FR
coconut
gamma-nonalactone (aldehyde C-18 (so-called))FL/FR
coffee
 coffee distillatesFL
cooling
isobutyl salicylateFL/FR
creamy
para-anisaldehydeFL/FR
 ethyl vanillateFL/FR
gamma-hexalactoneFL/FR
para-methyl acetophenoneFL/FR
gamma-undecalactone (aldehyde C-14 (so-called))FL/FR
fatty
 coconut absoluteFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
10-undecenal (aldehyde C-11 undecylenic)FL/FR
floral
2-acetyl-5-methyl thiopheneFL
 bois de rose oil brazilFL/FR
 citronellolFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 dimethyl benzyl carbinyl butyrateFL/FR
 geraniolFL/FR
 linalyl acetateFL/FR
 methyl dihydrojasmonateFL/FR
 methyl phenyl acetateFL/FR
 ocean propanalFL/FR
 phenethyl alcoholFL/FR
 phenethyl propionateFL/FR
 rhodinolFL/FR
 tetrahydrolinaloolFL/FR
fruity
isoamyl benzoateFL/FR
para-anisyl alcoholFL/FR
 benzyl acetateFL/FR
 benzyl alcoholFL/FR
 benzyl propionateFL/FR
 dimethyl anthranilateFL/FR
 methyl anthranilateFL/FR
 rose butanoateFL/FR
green
isoamyl salicylateFL/FR
 cinnamyl alcoholFL/FR
 cyclamen aldehydeFL/FR
 cyclohexyl ethyl alcoholFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
 linalool oxideFL/FR
 oakmoss absoluteFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
3-phenyl propionaldehydeFL/FR
2-vinyl pyrazineFL
herbal
 carum carvi fruit oilFL/FR
 clary sage oil franceFL/FR
 coriander seed oilFL/FR
 sunflower oilFL/FR
honey
 ethyl phenyl acetateFL/FR
 phenethyl phenyl acetateFL/FR
lactonic
gamma-heptalactoneFL/FR
gamma-octalactoneFL/FR
meaty
 phenyl mercaptanFL
medicinal
 dimethyl benzyl carbinolFL/FR
musty
2-ethoxythiazoleFL
naphthyl
2'-hydroxyacetophenoneFL/FR
para-methyl anisoleFL/FR
beta-naphthyl methyl etherFL/FR
nutty
2-acetyl furanFL/FR
2-acetyl-3-methyl pyrazineFL/FR
2-acetyl-4-methyl thiazoleFL
burnt almond flavorFL
2,5-diethyl-3-methyl pyrazineFL
 methyl benzoxoleFL/FR
 nut flavorFL
 peanut flavorFL
phenolic
2-hydroxyisophoroneFL
 propyl 2-furoateFL
powdery
ortho-acetanisoleFL/FR
 acetophenoneFL/FR
beta-naphthyl ethyl etherFL/FR
soapy
 dodecanal (aldehyde C-12 lauric)FL/FR
1-dodecanolFL/FR
spicy
 allspice oilFL/FR
 benzyl isoeugenolFL/FR
 benzylidene acetoneFL
 cassia bark oil chinaFL/FR
 cassie absoluteFL/FR
 clove bud oilFL/FR
 eugenolFL/FR
alpha-methyl cinnamaldehydeFL/FR
 methyl isoeugenolFL/FR
3-phenyl propyl alcoholFL/FR
sulfurous
 pyrazinylmethylthiol acetate 
tropical
alpha-amyl cinnamaldehydeFL/FR
vanilla
 ethyl vanillinFL/FR
 vanilla bean absolute (vanilla planifolia)FL/FR
 vanillyl acetateFL/FR
waxy
 decanolFL/FR
 ethyl laurateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hydroxycitronellalFL/FR
 mimosa absolute franceFL/FR
 nonanolFL/FR
woody
 amyris wood oilFL/FR
isobornyl acetateFL/FR
 cistus twig/leaf oilFL/FR
 guaiacwood oilFL/FR
 methyl cedryl ketoneFL/FR
 vetiver oil haitiFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 acaciaFR
 almondFR
 bois de roseFR
 butterscotchFR
 cherryFR
 chypreFR
 cloverFR
 crabapple blossomFR
 currant black currantFR
 decumariaFR
 dry 
 fernFR
 fir needle oil replacerFR
 flower shopFR
 genetFR
 grapeFR
 greenFR
 hawthornFR
 hay new mown hayFR
 herbalFR
 lavenderFR
 lilacFR
 mangoFR
 mimosaFR
 mossFR
 pineFR
 powderFR
 raspberryFR
 strawberryFR
 vanillaFR
 walnutFL
 wisteriaFR
 woodyFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 papaya fruit - 0.003 mg/kg
Search Trop  Picture
 star fruit
Search Trop  Picture
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Synonyms:
 acetophenone, 2'-methyl-
2-acetyl toluene
o-acetyl toluene
ortho-acetyl toluene
1-acetyl-2-methylbenzene
2-acetyltoluene
o-acetyltoluene
 ethanone, 1-(2-methylphenyl)-
2-methyl acetophenone
2'-methyl acetophenone
o-methyl acetophenone
 methyl o-tolyl ketone
 methyl ortho-tolyl ketone
1-(2-methyl phenyl) ethanone
2-methylacetophenone
2'-methylacetophenone
2’-methylacetophenone
o-methylacetophenone
ortho-methylacetophenone
1-(2-methylphenyl)-ethanone
1-(2-methylphenyl)ethanone
1-o-tolyl-ethanone
1-(o-tolyl)ethanone
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