(Z)-3-hexen-1-yl 2-methyl-2-pentenoate

General Material Information

Preferred name	(Z)-3-hexen-1-yl 2-methyl-2-pentenoate
Trivial Name	(3Z)-3-Hexen-1-yl 2-methyl-2-pentenoate
Short Description	cis-3-hexenyl 2-methyl-2-pentenoate
Formula	C12 H20 O2
CAS Number	76649-17-7
ECHA Number	278-511-5
FDA UNII	Search
xLogP3-AA	3.50 (est)
NMR Predictor	External link
Synonyms	green pentenoate [(E)- hex-3-enyl] (Z)-2-methylpent-2-enoate cis-3-hexen-1-yl 2-methyl-2-pentenoate (Z)-3-hexen-1yl 2-methyl pent-2-en-1-oate cis-3-hexen-1yl 2-methylpent-2-en-1-oate (Z)-3-hexenyl 2-methyl-2-pentenoate cis-3-hexenyl 2-methyl-2-pentenoate 2-methyl-2-pentenoic acid (3Z)-3-hexenyl ester 2-pentenoic acid, 2-methyl-, (3Z)-3-hexenyl ester [(E)-hex-3-enyl] (Z)-2-methylpent-2-enoate 2-Pentenoic acid, 2-methyl-, (3Z)-3-hexen-1-yl ester 2-Pentenoic acid, 2-methyl-, 3-hexenyl ester, (?,Z)- 2-Pentenoic acid, 2-methyl-, (3Z)-3-hexenyl ester (3Z)-3-Hexen-1-yl 2-methyl-2-pentenoate

(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
Export Tariff Code:	2916.19.6000
ChemSpider:	View

Material listed in food chemical codex	No
Molecular weight	196.28979492188
Specific gravity	@ 25 °C
Pounds per Gallon	7.497 to 7.589
Refractive Index	1.455 to 1.465 @ 20 °C
Vapor Pressure	0.01 mmHg @ 25 °C
Vapor Density	1
Flash Point TCC Value	104.44 °C TCC
logP (o/w)	4.222 est
Solubility
alcohol	Yes
water, 7.69 mg/L @ 25 °C (est)	Yes
water	No

Odor Type: Fruity
fresh, green, natural, metallic, tropical, waxy
Odor strength	high , recommend smelling in a 10.00 % solution or less
Substantivity	12 hour(s) at 100.00 %
Luebke, William tgsc, (1989)	At 10.00 % in dipropylene glycol. fresh green natural metallic tropical waxy
Flavor Type: Green
fresh, green, fruity, tropical, spicy, oily, waxy, mango, mahogany
Luebke, William tgsc, (1989)	Fresh green fruity tropical spicy oily waxy mango mahogany

Applications	fragrance agents
Odor purposes	Apple, Fruit, Green, Hyacinth, Jasmin, Reseda
Other purposes	Waxy

Preferred SDS: View
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes.

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 (Z)-3-hexen-1-yl 2-methyl-2-pentenoate usage levels up to:
	2.0000 % in the fragrance concentrate.

Recommendation for (Z)-3-hexen-1-yl 2-methyl-2-pentenoate flavor usage levels up to:
	not for flavor use.

AIDS Citations:Search

Cancer Citations:Search

Toxicology Citations:Search

EPA Substance Registry Services (TSCA):76649-17-7

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :6441873

National Institute of Allergy and Infectious Diseases:Data

[(E)-hex-3-enyl] (Z)-2-methylpent-2-enoate

Chemidplus:0076649177