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General Material Information

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
  • bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, propanoate, exo-
  • iso borneol propionate
  • iso borneol, propionate
  • iso bornyl propanoate
  • DL-iso bornyl propionate
  • exo-2-bornyl propionate
  • 2-bornyl propionate, exo-
  • exo-2-camphanyl propionate
  • 2-camphanyl propionate, exo-
  • exo-1,7,7-trimethyl bicyclo(2.2.1)hept-2-yl propionate
  • (rel-1,7,7-trimethyl bicyclo(2.2.1)heptan-2-ol propanoate
  • exo-1,7,7-trimethyl bicyclo(2.2.1)heptan-2-yl propanoate
  • (1,7,7-trimethyl-5-bicyclo[2.2.1]heptanyl) propanoate
  • 1,7,7-trimethylbicyclo(2.2.1)heptan-2-yl propanoate, exo-
  • (1,7,7-trimethyl-5-bicyclo[2.2.1]heptanyl) propanoate
  • Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, 2-propanoate, (1R,2R,4R)-rel-
  • Isoborneol, propionate
  • Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, propanoate, exo-
  • Propionic acid, isobornyl ester
  • Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, propanoate, (1R,2R,4R)-rel-
  • Isobornyl propanoate
  • NSC 67993

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

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Google Books Start search
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Perfumer & Flavorists Start search
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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
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

PhysChem Properties

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

Organoleptic Properties

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

Occurrences

Potential Uses

Applications
Odor purposes Fern, Herbal, Lavender, Pine, Turpentine
Flavoring purposes Turpentine
Cosmetic purposes Perfuming agents

Safety Information

Safety information

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

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 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 ppmaverage maximum ppm
baked goods: -1.80000
beverages(nonalcoholic): 0.010001.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 0.800001.00000
fruit ices: 0.800001.00000
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: --

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 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