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terpinyl formate

Chemical Structure

General Material Information

Preferred name terpinyl formate
Trivial Name α-Terpinyl formate
Short Description alpha-terpinyl formate
Formula C11 H18 O2
CAS Number 2153-26-6
FEMA Number 3052
Flavis Number 9.081
ECHA Number 218-444-0
FDA UNII GTJ0954O31
Nikkaji Number J183.097J
MDL MFCD00036672
COE Number 348
xLogP3-AA 2.40 (est)
NMR Predictor External link
JECFA Food Flavoring 367 terpinyl formate
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 2153-26-6 ; TERPINYL FORMATE
Synonyms
  • 3-cyclohexene-1-methanol, a,a,4-trimethyl-, formate
  • p- menth-1-en-8-ol formate
  • para- menth-1-en-8-ol formate
  • p- menth-1-en-8-ol, formate
  • p- menth-1-en-8-yl formate
  • para- menth-1-en-8-yl formate
  • p- menth-1-en-8-yl-formate
  • p-1-menthen-8-yl formate
  • 1-methyl-1-(4-methyl cyclohex-3-enyl) ethyl methanoate
  • 1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl formate
  • 1-methyl-1-(4-methylcyclohex-3-enyl)ethylmethanoate
  • 2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl formate
  • 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl formate
  • a- terpinyl formate
  • alpha- terpinyl formate
  • alpha terpinyl formate
  • terpinyl formate natural
  • terpinylformate
  • alpha,alpha,4-trimethyl-3-cyclohexene-1-methyl formate
  • 2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl formate
  • 3-Cyclohexene-1-methanol, α,α,4-trimethyl-, 1-formate
  • p-Menth-1-en-8-ol, formate
  • 3-Cyclohexene-1-methanol, α,α,4-trimethyl-, formate
  • α-Terpinyl formate
  • Terpenol formate
  • 2-(4-Methylcyclohex-3-en-1-yl)propan-2-yl formate
  • 2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl formate

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

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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):HMDB32050
FooDB:FDB008755
Export Tariff Code:2915.13.0000
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 182.26286315918
Specific gravity @ 25 °C
Pounds per Gallon 8.13 to 8.18
Specific gravity @ 15.5 °C
Pounds per Gallon 8.213 to 8.263
Refractive Index 1.468 to 1.473 @ 20 °C
Refractive Index 1.467 to 1.473 @ 20 °C
Boiling Point 213 to 225°C @ 760 mm Hg
Vapor Pressure 0.047 mmHg @ 25 °C
Flash Point TCC Value 97.22 °C TCC
logP (o/w) 3.313 est
Solubility
alcohol Yes
water, very slightly Yes
water, 31.13 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Floral
floral, lavender, citrus, fruity, cypress, herbal, woody
Odor strength medium
Substantivity > 8 hour(s) at 100.00 %
Luebke, William tgsc, (2017) At 100.00 %. floral lavender citrus fruity cypress herbal woody
Flavor Type: Fruity
dry, fruity, herbal, terpenic, spicy, woody, green
Luebke, William tgsc, (2017) Dry fruity herbal terpenic spicy woody green
Concord grape and other fruits, citrus especially mandarine. Sweet, floral, concord grape, and mandarine

Occurrences

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
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:
2 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg
(Moreno, 1976t)

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
(Moreno, 1976t)

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 terpinyl formate usage levels up to:
8.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.12 (μg/capita/day)
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: 6.0000010.00000
beverages(nonalcoholic): 0.500003.00000
beverages(alcoholic): -1.00000
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 2.600005.00000
fruit ices: 2.600005.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 6.0000010.00000
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 18 (FGE.18): Aliphatic, alicyclic and aromatic saturated and unsaturated tertiary alcohols, aromatic tertiary alcohols and their esters from chemical group 6
View page or View pdf

Flavouring Group Evaluation 18, Revision 1 (FGE. 18 Rev1)[1] : Aliphatic, alicyclic and aromatic saturated and unsaturated tertiary alcohols, aromatic tertiary alcohols and their esters from chemical groups 6 and 8
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):2153-26-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :16537
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl formate
Chemidplus:0002153266