heptyl heptanoate

General Material Information

Preferred name	heptyl heptanoate
Trivial Name	Heptanoic acid, heptyl ester
Short Description	heptanoic acid, heptyl ester
Formula	C14 H28 O2
CAS Number	624-09-9
FEMA Number	4341
ECHA Number	210-828-6
FDA UNII	BG2A3OKN56
Nikkaji Number	J95.502G
xLogP3-AA	5.40 (est)
NMR Predictor	External link
JECFA Food Flavoring	1875 heptyl heptanoate
FDA Patent	No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm	624-09-9 ; HEPTYL HEPTANOATE
Synonyms	heptanoic acid heptyl ester heptanoic acid, heptyl ester heptanoicacid,heptylester heptyl capronate heptyl heptoate heptylheptanoate 1-Heptyl heptanoate

(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):	HMDB34461
FooDB:	FDB012870
Export Tariff Code:	2915.90.0000
ChemSpider:	View

Alfrebro	Axsyn
BOC Sciences	Penta International
Sigma-Aldrich	Alfrebro LLC/ Archer Daniels Midland Company
Penta International Corporation

Material listed in food chemical codex	No
Molecular weight	228.3755645752
Specific gravity	@ 20 °C
Pounds per Gallon	7.156 to 7.206
Refractive Index	1.428 to 1.432 @ 20 °C
Boiling Point	276 to 277°C @ 760 mm Hg
Vapor Pressure	0.005 mmHg @ 25 °C
Flash Point TCC Value	120 °C TCC
logP (o/w)	5.88 est
Solubility
alcohol	Yes
water, 0.3631 mg/L @ 25 °C (est)	Yes
water	No

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

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 heptyl heptanoate usage levels up to:
	8.0000 % in the fragrance concentrate.

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: 23
Click here to view publication 23
		average usual ppm	average maximum ppm
baked goods:		-	-
beverages(nonalcoholic):		3.00000	15.00000
beverages(alcoholic):		-	-
breakfast cereal:		-	-
cheese:		-	-
chewing gum:		25.00000	100.00000
condiments / relishes:		-	-
confectionery froastings:		-	-
egg products:		-	-
fats / oils:		-	-
fish products:		-	-
frozen dairy:		-	-
fruit ices:		-	-
gelatins / puddings:		10.00000	20.00000
granulated sugar:		-	-
gravies:		-	-
hard candy:		5.00000	25.00000
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:		5.00000	20.00000
soups:		-	-
sugar substitutes:		-	-
sweet sauces:		-	-

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :69350

National Institute of Allergy and Infectious Diseases:Data

heptyl heptanoate

Chemidplus:0000624099