3-isopropenyl pentane dioic acid

General Material Information

Preferred name	3-isopropenyl pentane dioic acid
Trivial Name	3-(1-Methylethenyl)pentanedioic acid
Short Description	3-isopropenylpentanedioic acid
Formula	C8 H10 O4
CAS Number	6839-75-4
FEMA Number	4352
FDA UNII	AX5QW8656N
Nikkaji Number	J1.014.516C
xLogP3-AA	0.70 (est)
NMR Predictor	External link
JECFA Food Flavoring	1620 3-isopropenylpentanedioic acid
FDA Patent	No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm	6839-75-4 ; 3-ISOPROPENYLPENTANEDIOIC ACID
Synonyms	3-(1-methylethenyl)pentanedioic acid 3-(1-methylvinyl)pentanedioic acid 3-( prop-1-en-2-yl)pentanedioic acid 3-iso propenyl pentanedioic acid 3-iso propenylglutaric acid 3-iso propenylpentanedioic acid 3-(prop-1-en-2-yl)pentanedioic acid Pentanedioic acid, 3-(1-methylethenyl)- Glutaric acid, 3-isopropenyl- 3-(1-Methylethenyl)pentanedioic acid 3-Prop-1-en-2-ylpentanedioic acid 3-Isopropenyl-glutaric acid

(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):	HMDB32352
FooDB:	FDB009649
ChemSpider:	View

Material listed in food chemical codex	No
Molecular weight	170.16450500488
Boiling Point	297 to 299°C @ 760 mm Hg
Vapor Pressure	4.5E-5 mmHg @ 25 °C
Flash Point TCC Value	165 °C TCC
logP (o/w)	0.683 est
Solubility
water, 1.868e+004 mg/L @ 25 °C (est)	Yes

Odor Type: Savory
savory, cooked, roasted
General comment	At 10.00 % in dipropylene glycol. savory cooked roasted


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:
flavoring agents
Recommendation for 3-isopropenyl pentane dioic acid usage levels up to:
	not for fragrance use.

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):		-	-
beverages(alcoholic):		-	-
breakfast cereal:		-	-
cheese:		-	-
chewing gum:		0.20000	1.00000
condiments / relishes:		-	-
confectionery froastings:		-	-
egg products:		-	-
fats / oils:		-	-
fish products:		-	-
frozen dairy:		-	-
fruit ices:		-	-
gelatins / puddings:		-	-
granulated sugar:		-	-
gravies:		-	-
hard candy:		0.10000	0.50000
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:		0.20000	1.00000
soups:		-	-
sugar substitutes:		-	-
sweet sauces:		-	-

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :71586903

National Institute of Allergy and Infectious Diseases:Data

3-(prop-1-en-2-yl)pentanedioic acid

Chemidplus:0006839754