Preferred name | isobornyl propionate |
Trivial Name | Isobornyl propionate |
Short Description | DL-isobornyl propionate |
Formula | C13 H22 O2 |
CAS Number | 2756-56-1 |
FEMA Number | 2163 |
Flavis Number | 9.131 |
ECHA Number | 220-410-5 |
FDA UNII | 7T3RQY66IC |
MDL | MFCD00270403 |
COE Number | 412 |
xLogP3-AA | 3.60 (est) |
NMR Predictor | External link |
JECFA Food Flavoring | 1391 isobornyl propionate |
FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
FDA Mainterm | 2756-56-1 ; ISOBORNYL PROPIONATE |
Synonyms |
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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 |
(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): | HMDB38249 |
FooDB: | FDB017542 |
Export Tariff Code: | 2915.50.3000 |
Typical G.C. | |
VCF-Online: | VCF Volatile Compounds in Food |
ChemSpider: | View |
Material listed in food chemical codex | No |
Molecular weight | 210.31674194336 |
Specific gravity | @ 25 °C |
Pounds per Gallon | 8.055 to 8.08 |
Specific gravity | @ 20 °C |
Pounds per Gallon | 8.064 to 8.131 |
Refractive Index | 1.461 to 1.465 @ 20 °C |
Vapor Pressure | 0.045 mmHg @ 25 °C |
Flash Point TCC Value | 99.44 °C TCC |
logP (o/w) | 4.026 est |
Solubility | |
alcohol | Yes |
water, 7.491 mg/L @ 25 °C (est) | Yes |
water | No |
Stability | |
acid cleaner | Unspecified |
antiperspirant | Unspecified |
deo stick | Unspecified |
detergent perborate | Unspecified |
fabric softener | Unspecified |
hard surface cleaner | Unspecified |
liquid detergent | Unspecified |
shampoo | Unspecified |
soap | Unspecified |
Odor Type: Balsamic | |
pungent, pine, camphoreous, woody, lavender, fruity, herbal, earthy | |
Odor strength | medium |
Substantivity | 20 hour(s) at 100.00 % |
Luebke, William tgsc, (1989) | At 100.00 %. pungent pine camphor woody lavender |
Flavor Type: Balsamic | |
fir needle, balsamic, herbal, camphoreous, woody | |
Luebke, William tgsc, (1989) | Fir balsamic herbal sweet camphoreous woody |
(data available) |
Applications | |
Odor purposes | Fern, Herbal, Lavender, Pine, Turpentine |
Flavoring purposes | Turpentine |
Cosmetic purposes | Perfuming agents |
European information : | |
Most important hazard(s): | |
Xi - Irritant | |
R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection. | |
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. | |
Human Experience: | |
10 % solution: no irritation or sensitization. | |
Oral/Parenteral Toxicity: | |
oral-rat LD50 > 5000 mg/kg (Moreno, 1973al) | |
Dermal Toxicity: | |
Not determined | |
Inhalation Toxicity: | |
Not determined |
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 isobornyl propionate usage levels up to: | |||
30.0000 % in the fragrance concentrate. | |||
Maximised Survey-derived Daily Intakes (MSDI-EU): | 2.60 (μg/capita/day) | ||
Maximised Survey-derived Daily Intakes (MSDI-USA): | 0.007 (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 ppm | average maximum ppm | ||
baked goods: | - | 1.80000 | |
beverages(nonalcoholic): | 0.01000 | 1.00000 | |
beverages(alcoholic): | - | - | |
breakfast cereal: | - | - | |
cheese: | - | - | |
chewing gum: | - | - | |
condiments / relishes: | - | - | |
confectionery froastings: | - | - | |
egg products: | - | - | |
fats / oils: | - | - | |
fish products: | - | - | |
frozen dairy: | 0.80000 | 1.00000 | |
fruit ices: | 0.80000 | 1.00000 | |
gelatins / puddings: | - | - | |
granulated sugar: | - | - | |
gravies: | - | - | |
hard candy: | - | 1.20000 | |
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: | - | - |
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 47, (FGE.47)[1] - Bicyclic secondary alcohols, ketones and related esters from chemical group 8 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf |
Flavouring Group Evaluation 87, (FGE.87)[1] - Consideration of bicyclic secondary alcohols, ketones and related esters evaluated by JECFA (63rd meeting) structurally related to bicyclic secondary alcohols, ketones and related esters evaluated by EFSA in FGE.47 (2008) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 87 Revision 1 (FGE.87Rev1): Consideration of bicyclic secondary alcohols, ketones and related esters evaluated by JECFA (63rd meeting) structurally related to bicyclic secondary alcohols, ketones and related esters evaluated by EFSA in FGE.47 (2008) View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 87, Revision 2 (FGE.87Rev2): Consideration of bicyclic secondary alcohols, ketones and related esters evaluated by JECFA (63rd meeting) structurally related to bicyclic secondary alcohols, ketones and related esters evaluated by EFSA in FGE.47Rev1 (2008) View page or View pdf |
EPI System: View |
AIDS Citations:Search |
Cancer Citations:Search |
Toxicology Citations:Search |
EPA Substance Registry Services (TSCA):2756-56-1 |
EPA ACToR:Toxicology Data |
EPA Substance Registry Services (SRS):Registry |
Laboratory Chemical Safety Summary :17685 |
National Institute of Allergy and Infectious Diseases:Data |
WGK Germany:2 |
(1,7,7-trimethyl-5-bicyclo[2.2.1]heptanyl) propanoate |
Chemidplus:0002756561 |