methyl cyclogeranate (Firmenich)

General Material Information

Preferred name	methyl cyclogeranate (Firmenich)
Trivial Name	Methyl 2,6,6-trimethyl-2-cyclohexene-1-carboxylate
Short Description	2,6,6-trimethyl-2-cyclohexene-1-carboxylic acid, methyl ester
Formula	C11 H18 O2
CAS Number	28043-10-9
Deleted CAS Number	88269-68-5
ECHA Number	248-792-9
FDA UNII	Search
Nikkaji Number	J250.635A
xLogP3-AA	2.60 (est)
NMR Predictor	External link
Synonyms	2-cyclohexene-1-carboxylic acid 2,6,6,-trimethyl methyl ester 2-cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester methyl 2,6,6-trimethyl cyclohex-2-ene carboxylate methyl 2,6,6-trimethyl cyclohex-2-ene-1-carboxylate methyl 2,6,6-trimethylcyclohex-2-ene-1-carboxylate methyl cyclo geranate methylcyclogeranate 2,6,6-trimethyl-2-cyclohexene-1-carboxylic acid, methyl ester 2-Cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester Methyl 2,6,6-trimethyl-2-cyclohexene-1-carboxylate Methyl α-cyclogeranate 2,6,6-Trimethyl-1-methoxycarbonyl-2-cyclohexene α-Cyclogeranic acid methyl ester Cyclogeranic acid methyl ester

(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

Azelis UK	Ernesto Ventós
Firmenich	Lluch Essence
Moellhausen	Organica Aromatics
Penta International	Vigon International
Azelis UK Ltd.	Firmenich Inc.
Lluch Essence S.L.	Moellhausen S.P.A.
Penta International Corporation	Ernesto Ventós S.A.

Material listed in food chemical codex	No
Molecular weight	182.26286315918
Specific gravity	@ 25 °C
Pounds per Gallon	7.971 to 8.056
Refractive Index	1.491 to 1.499 @ 20 °C
Boiling Point	212 to 214°C @ 760 mm Hg
Vapor Pressure	0.151 mmHg @ 25 °C
Vapor Density	6.3
Flash Point TCC Value	77.22 °C TCC
logP (o/w)	3.372 est
Solubility
alcohol	Yes
water, 27.88 mg/L @ 25 °C (est)	Yes
water	No

Odor Type: Herbal
natural, herbal, floral, fruity, woody, camphoreous
Odor strength	medium
Substantivity	1 hour(s) at 100.00 %
Luebke, William tgsc, (1985)	At 100.00 %. natural herbal floral fruity woody camphor

Applications	fragrance agents
Odor purposes	Basil oil replacer, Chamomile, Chypre, Flower shop, Fruit, Green, Herbal, Rosemary, Woody
Cosmetic purposes	Perfuming agents


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:
oral-rat LD50 4150 mg/kg Firmenich Inc.
Dermal Toxicity:
skin-rabbit LD50 > 2000 mg/kg Firmenich Inc.
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 methyl cyclogeranate (Firmenich) usage levels up to:
	5.0000 % in the fragrance concentrate.

Recommendation for methyl cyclogeranate (Firmenich) flavor usage levels up to:
	not for flavor use.

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (TSCA):28043-10-9

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :119800

National Institute of Allergy and Infectious Diseases:Data

methyl 2,6,6-trimethylcyclohex-2-ene-1-carboxylate

Chemidplus:0028043109