tetrahydrojasmone

General Material Information

Preferred name	tetrahydrojasmone
Trivial Name	3-Methyl-2-pentylcyclopentanone
Short Description	cyclopentanone, 3-methyl-2-pentyl-
Formula	C11 H20 O
CAS Number	13074-63-0
ECHA Number	235-969-0
FDA UNII	Search
Nikkaji Number	J317.794G
xLogP3-AA	3.40 (est)
NMR Predictor	External link
Synonyms	cyclopentanone, 3-methyl-2-pentyl- 3-methyl-2-pentyl cyclopentan-1-one 3-methyl-2-pentyl cyclopentanone 3-methyl-2-pentylcyclopentan-1-one 3-methyl-2-pentylcyclopentanone 3-methyl-2-pentylcyclopentan-1-one Cyclopentanone, 2-amyl-3-methyl- 3-Methyl-2-pentylcyclopentanone 2-Pentyl-3-methylcyclopentan-1-one

(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
HMDB (The Human Metabolome Database):	Search
ChemSpider:	View

Ernesto Ventós	Moellhausen
Penta International	Moellhausen S.P.A.
Penta International Corporation	Ernesto Ventós S.A.

Material listed in food chemical codex	No
Molecular weight	168.27960205078
Specific gravity	@ 25 °C
Pounds per Gallon	7.322 to 7.406
Refractive Index	1.4 to 1.5 @ 20 °C
Boiling Point	230 to 231°C @ 760 mm Hg
Vapor Pressure	0.066 mmHg @ 25 °C
Flash Point TCC Value	93.33 °C TCC
logP (o/w)	3.403 est
Solubility
alcohol	Yes
water, 73.11 mg/L @ 25 °C (est)	Yes
water	No

Odor Type: Coconut
coconut, sweet, jasmin, spicy, fruity
General comment	At 100.00 %. coconut sweet jasmin spicy fruity
Used in jasmine, coconut, and tropical blends.	Coconut jasmine character

Applications	fragrance agents
Odor purposes	Apricot, Blackberry, Butter, Butterscotch, Caraway seed, Christmas, Coconut, Cream, Gardenia, Honey, Jasmin, Mango, Oakwood, Peach, Pina colada, Raspberry, Root beer, Strawberry, Tuberose, Vanilla
Flavoring purposes	Caraway seed, Chocolate cocoa, Cookie, Fat, Fruit tropical fruit, Milk, Tropical

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.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Category:
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 tetrahydrojasmone usage levels up to:
	8.0000 % in the fragrance concentrate.

Recommendation for tetrahydrojasmone flavor usage levels up to:
	not for flavor use.

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (TSCA):13074-63-0

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :114453

National Institute of Allergy and Infectious Diseases:Data

3-methyl-2-pentylcyclopentan-1-one

Chemidplus:0013074630