We have found 46587 results matching your criteria.
Please wait while we search...
  1. 1.
    General Material Information
  2. 2.
    PhysChem Properties
  3. 3.
    Occurrences
  4. 4.
    Organoleptic Properties
  5. 5.
    Suppliers
  6. 6.
    Potential Uses
  7. 7.
    Regulatory & Documentation
  8. 8.
    Safety Information
  9. 9.
    Other Information
  10. 10.
    Blenders & Components
  11. 11.
    Literature & References

para-isopropyl acetophenone

Chemical Structure

General Material Information

Preferred name para-isopropyl acetophenone
Trivial Name 1-[4-(1-Methylethyl)phenyl]ethanone
Short Description p-isopropylacetophenone
Formula C11 H14 O
CAS Number 645-13-6
FEMA Number 2927
Flavis Number 7.042
ECHA Number 211-433-1
FDA UNII 742ZKZ2A6D
Nikkaji Number J30.873K
MDL MFCD00048297
COE Number 651
Bio Activity Summary External link
NMR Predictor External link
JECFA Food Flavoring 808 p-isopropylacetophenone
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 645-13-6 ; P-ISOPROPYLACETOPHENONE
Synonyms
  • acetocumene
  • acetophenone, 4-isopropyl-
  • p- acetyl cumene
  • para- acetyl cumene
  • 1-acetyl-4-(methylethyl)benzene
  • p- acetylcumene
  • cuminone
  • ethanone, 1-[4-(1-methylethyl)phenyl]-
  • 1-(4-(1-methyl ethyl)phenyl) ethan-1-one
  • methyl p-isopropyl phenyl ketone
  • methyl p-isopropylphenyl ketone
  • methyl para-isopropyl phenyl ketone
  • methyl para-isopropylphenyl ketone
  • 1-(4-(1-methylethyl)phenyl)ethan-1-one
  • 1-[4-(1-methylethyl)phenyl]ethan-1-one
  • 1-[4-( propan-2-yl)phenyl]ethanon
  • 1-(4-propan-2-ylphenyl)ethanone
  • 4'-iso propyl acetophenone
  • p-iso propyl acetophenone
  • para-iso propyl acetophenone
  • p-iso propyl acetyl benzene
  • para-iso propyl acetyl benzene
  • p-iso propyl phenyl methyl ketone
  • para-iso propyl phenyl methyl ketone
  • 1-(4-iso propyl phenyl) ethanone
  • 4-iso propylacetophenone
  • 4'-iso propylacetophenone
  • 4'-iso- propylacetophenone
  • p-iso propylacetophenone
  • para-iso propylacetophenone
  • p-iso propylacetylbenzene
  • 4-iso propylphenyl methyl ketone
  • 1-(4-iso propylphenyl) ethanone
  • 1-(4-iso propylphenyl)ethanone
  • 4-iso propylphenylmethyl ketone
  • 1-(4-propan-2-ylphenyl)ethanone
  • Acetophenone, 4′-isopropyl-
  • 1-[4-(1-Methylethyl)phenyl]ethanone
  • p-Isopropylacetophenone
  • 4-Isopropylacetophenone
  • 4′-Isopropylacetophenone
  • NSC 9165
  • 1-(4-Isopropylphenyl)ethanone
  • 1-(4-Isopropylphenyl)ethan-1-one
  • 1-[4-(Propan-2-yl)phenyl]ethan-1-one

US / EU / FDA / JECFA / FEMA / Scholar / Patents

Google Scholar Start search
Google Books Start search
Google Patents Start search
Perfumer & Flavorists Start search
EU Patents Start search
PubMeb Start search
NCBI Start search

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):HMDB32025
FooDB:FDB008723
Export Tariff Code:2914.39.9000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 162.23178100586
Specific gravity @ 25 °C
Pounds per Gallon 8.046 to 8.113
Refractive Index 1.52 to 1.527 @ 20 °C
Boiling Point 252 to 254°C @ 760 mm Hg
Vapor Pressure 0.017 mmHg @ 25 °C
Flash Point TCC Value 101.11 °C TCC
logP (o/w) 2.98
Solubility
alcohol Yes
water, 190.6 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Orris
spicy, woody, herbal, orris
General comment At 100.00 %. spicy woody herbal orris
Flavor Type: Spicy
warm, spicy
General comment Warm spicy

Occurrences

Potential Uses

Applications
Odor purposes Basil oil replacer, Foliage, Fungus, Jonquil, Lily of the valley, Orris
Flavoring purposes Pickle
Other purposes Blossom tropical blossom
Cosmetic purposes Perfuming agents

Safety Information

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

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 para-isopropyl acetophenone usage levels up to:
1.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.40 (μg/capita/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: 3
Click here to view publication 3
average usual ppmaverage maximum ppm
baked goods: -1.00000
beverages(nonalcoholic): -0.08000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: -5.00000
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -0.10000
fruit ices: -0.10000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -0.50000
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: --

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 16 (FGE.16): Aromatic ketones from chemical group 21 (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf

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 69, (FGE.69)[1] - Consideration of aromatic substituted secondary alcohols, ketones and related esters evaluated by JECFA (57th meeting) structurally related to aromatic ketones from chemical group 21 evaluated by EFSA in FGE.16 (2006) - 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

Scientific Opinion on Flavouring Group Evaluation 69, Revision 1 (FGE.69Rev1): consideration of aromatic substituted secondary alcohols, ketones and related esters evaluated by JECFA (57th meeting), structurally related to aromatic ketones from chemical group 21 evaluated by EFSA in FGE.16Rev2
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):645-13-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12578
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
1-(4-propan-2-ylphenyl)ethanone
Chemidplus:0000645136