para-isopropyl acetophenone
p-isopropylacetophenone
Identification
| Name | para-isopropyl acetophenone |
| IUPAC | 1-(4-propan-2-ylphenyl)ethanone |
| CAS Number | 645-13-6 |
| EINECS | 211-433-1 |
| FDA UNII | 742ZKZ2A6D |
| Molecular Formula | C11 H14 O |
| Molecular Weight | 162.23178000 |
| MDL Number | MFCD00048297 |
| Nikkaji Number | J30.873K |
| CoE Number | 651 |
| XlogP3 | 3.00 (est) |
Regulatory
| JECFA Food Flavoring | 808 p-isopropylacetophenone |
| DG SANTE Food Flavourings | 07.042 4-isopropylacetophenone |
| FEMA Number | 2927 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 645-13-6 ; P-ISOPROPYLACETOPHENONE |
| FDA Regulation | FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 sum of isomers |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.96700 to 0.97500 @ 25.00 °C. |
| Pounds per Gallon - (est). | 8.046 to 8.113 |
| Refractive Index | 1.52000 to 1.52700 @ 20.00 °C. |
| Boiling Point | 252.00 to 254.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.017000 mmHg @ 25.00 °C. (est) |
| Flash Point | 214.00 °F. TCC ( 101.11 °C. ) |
| logP (o/w) | 2.980 |
| Soluble in | alcohol |
| Insoluble in | water |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Description | at 100.00 %. |
| Taste Description | warm spicy |
Safety Information
| Preferred SDS | View |
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| 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 |
| 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 / 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 | - |
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 Molecul...
Penta International Corporation
Chemistry innovation
At Penta, our products and services help businesses do business better.
Synerzine, Inc.
Innovation. Customization. Aroma Ingredients.
Synerzine is a leading supplier of flavor and fragrance ingredients.
Potential Uses
Natural Occurrence
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
Try the PubMed Search.